data_2adz_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 2adz _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 ' 7' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo . . . . . 0 N--CA 1.466 -0.134 0 CA-C-O 120.74 0.225 . . . . 0.0 112.281 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.5 ttm-85 -82.56 130.25 35.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.559 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 21.7 p -120.65 146.37 46.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.971 0.415 . . . . 0.0 111.224 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -134.73 127.69 4.54 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.465 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.1 mt -69.82 101.24 1.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.944 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.23 164.2 17.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.717 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -89.55 163.79 15.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.959 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 18.1 tp -137.53 124.67 21.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.665 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.477 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 33.8 ttt180 . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.657 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.477 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.4 m95 . . . . . 0 CA--C 1.528 0.098 0 CA-C-O 120.807 0.336 . . . . 0.0 111.167 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -166.63 141.61 4.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -64.2 136.04 56.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.007 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 31.6 m -146.36 169.98 5.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.12 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -107.17 141.62 38.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.725 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.9 mp -114.54 82.84 1.79 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.901 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.95 88.9 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.58 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 tp -87.73 119.18 27.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.236 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -109.79 156.07 20.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.815 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -49.9 -22.82 1.64 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.793 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -152.87 38.14 0.51 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.204 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -175.2 119.92 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.957 0.408 . . . . 0.0 111.646 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -104.16 100.88 10.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.496 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.415 HG23 ' CD2' ' A' ' 122' ' ' HIS . 85.5 m -109.78 126.75 54.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.369 -179.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.5 t -94.56 158.57 2.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.391 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -149.52 166.4 15.33 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.904 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -82.6 50.72 3.49 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.658 2.238 . . . . 0.0 112.46 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.188 -179.867 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 120.85 0.357 . . . . 0.0 111.084 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.59 82.8 2.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.928 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.415 ' CD2' HG23 ' A' ' 40' ' ' THR . 14.5 m-70 -76.18 135.62 39.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.829 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.5 t -138.62 120.77 17.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.116 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 5.6 m -59.69 151.38 25.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.858 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 59.7 mt -109.32 38.08 2.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.899 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.93 34.23 4.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.833 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 10.5 ptt? 179.3 -36.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.044 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.85 -176.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.379 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.465 ' CD1' ' N ' ' A' ' 129' ' ' TYR . 0.0 OUTLIER -167.44 125.79 1.28 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.472 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.468 ' CG2' ' N ' ' A' ' 131' ' ' SER . 2.2 p -94.19 159.18 2.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 121.255 0.55 . . . . 0.0 111.406 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.468 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 34.4 p -157.85 134.89 10.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.86 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 9.8 ttm105 -96.15 95.64 8.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.874 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.95 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.858 0.361 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.0 140.55 51.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.794 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . 0.43 ' CG ' ' CE2' ' A' ' 156' ' ' PHE . 6.0 tm-20 -148.68 126.49 11.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.826 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 29.6 mt -126.41 118.51 51.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.161 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 7.8 m -99.56 138.15 37.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.814 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -114.24 149.07 36.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.219 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.14 30.4 2.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.286 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -115.23 45.03 1.71 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.186 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.3 22.73 3.37 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.132 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.401 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.6 mm-40 58.1 61.06 2.45 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.17 0.51 . . . . 0.0 110.968 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -87.43 157.67 19.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.911 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -156.47 90.93 1.2 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.119 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 7.3 m -84.61 118.66 32.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.233 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.43 ' CE2' ' CG ' ' A' ' 145' ' ' GLU . 70.2 m-85 -106.18 116.19 31.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.749 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -127.18 160.58 30.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.03 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.44 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 5.2 tmm_? -135.78 94.11 3.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.811 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -54.92 172.35 0.11 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.366 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.07 -32.66 11.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.885 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -98.32 162.39 13.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.931 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.46 -51.64 6.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.955 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -69.07 -30.62 68.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 20.2 m -67.66 -52.84 33.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.652 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.34 -35.83 78.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.976 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -43.62 54.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.491 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 5.1 m -67.75 -30.15 69.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.046 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 5.4 m95 -71.28 -50.95 27.35 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.972 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . 0.428 ' O ' HG13 ' A' ' 130' ' ' VAL . . . -56.09 -51.52 67.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.325 0.583 . . . . 0.0 110.575 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -56.81 -41.03 90.63 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.58 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.21 -40.58 77.91 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.842 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.449 HG23 ' CD1' ' A' ' 176' ' ' ILE . 18.3 mt -60.07 -24.68 30.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.445 ' N ' HG13 ' A' ' 130' ' ' VAL . 4.2 tt0 -82.52 -28.35 31.14 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.255 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.11 -49.67 69.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.116 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -68.74 -41.07 79.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.75 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . 0.449 ' CD1' HG23 ' A' ' 172' ' ' ILE . 91.7 mt -76.79 -7.55 10.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.282 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.481 179.85 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo . . . . . 0 C--O 1.23 0.124 0 CA-C-O 120.889 0.287 . . . . 0.0 112.284 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -79.39 141.04 37.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.775 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.8 p -139.17 138.8 37.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.058 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -146.18 127.25 2.72 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.418 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.2 mt -59.03 103.99 0.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.775 0.322 . . . . 0.0 110.985 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.2 170.13 8.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.723 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -114.66 151.64 33.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.003 0.43 . . . . 0.0 111.123 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.408 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 1.2 tp -137.48 142.38 41.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.407 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.57 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 120.887 0.375 . . . . 0.0 110.891 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.57 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 12.8 m95 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.783 0.325 . . . . 0.0 110.829 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.85 179.11 6.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.907 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.4 ttp180 -112.32 133.41 54.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.895 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.408 ' CG2' ' CD2' ' A' ' 157' ' ' LEU . 27.7 m -139.54 120.91 15.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.206 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.9 tp -71.53 128.99 37.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.596 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.27 132.16 40.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.026 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -108.97 84.97 2.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.778 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.3 tp -82.0 108.88 15.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.997 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.58 146.39 44.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.022 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -61.5 -16.24 45.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.485 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -95.3 -25.51 16.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.994 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -179.07 178.52 0.73 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.917 0.389 . . . . 0.0 111.089 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.07 113.12 18.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.801 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.421 HG23 ' CD2' ' A' ' 122' ' ' HIS . 56.5 m -116.8 134.16 55.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.942 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.1 t -115.8 159.77 15.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.17 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.2 t -155.56 157.8 31.67 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.553 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -75.24 44.43 1.2 Allowed 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.943 2.429 . . . . 0.0 112.725 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.152 0 CA-C-O 120.917 0.389 . . . . 0.0 111.348 179.838 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.059 0 CA-C-O 120.871 0.367 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.56 88.64 2.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.922 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.421 ' CD2' HG23 ' A' ' 40' ' ' THR . 14.8 m-70 -85.8 139.53 31.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.062 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 11.2 t -122.87 120.87 61.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.882 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.99 -28.31 16.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.317 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.2 tp 62.69 -174.38 0.15 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.754 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt 57.54 37.2 27.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.835 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.99 -36.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.925 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.402 ' HB1' ' CG1' ' A' ' 176' ' ' ILE . . . -56.08 -169.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.071 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -161.89 116.56 1.93 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.956 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.469 ' CG2' ' N ' ' A' ' 131' ' ' SER . 1.4 p -97.08 158.69 3.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.184 0.516 . . . . 0.0 111.154 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.2 m -163.88 156.41 17.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.84 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 19.7 ttp-105 -122.54 93.67 4.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.978 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.72 179.826 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.406 ' CE1' ' HD2' ' A' ' 158' ' ' ARG . 3.4 m-30 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.759 0.314 . . . . 0.0 110.937 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.33 98.75 11.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.655 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 8.3 tm-20 -102.74 132.09 49.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.976 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 5.1 mp -135.74 111.58 12.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.906 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.5 m -100.6 134.09 44.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.873 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -108.11 145.31 34.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.283 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.56 31.55 2.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.104 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -125.35 50.1 1.83 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.283 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 126.13 14.61 2.98 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.663 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 61.06 62.93 1.33 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.063 0.459 . . . . 0.0 110.896 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -92.15 151.84 20.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.758 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -157.8 91.81 1.16 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.069 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 14.0 m -94.36 115.73 33.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.301 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -105.21 89.59 3.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.554 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.408 ' CD2' ' CG2' ' A' ' 30' ' ' VAL . 1.1 mt -104.88 167.96 9.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.302 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.447 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 14.7 ttt-85 -127.43 103.16 7.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.616 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -55.01 173.57 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.294 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -77.49 -69.54 0.53 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.068 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -110.25 177.6 4.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.04 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.85 -42.65 66.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.011 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -63.75 -50.86 67.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.982 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -46.58 88.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.591 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.29 -37.4 83.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.962 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.4 -47.9 58.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.443 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 56.3 m -64.7 -33.1 75.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.067 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 11.7 m95 -73.61 -50.8 19.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.712 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -57.15 -46.48 82.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.286 0.565 . . . . 0.0 110.474 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -60.49 -43.09 99.18 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.768 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.82 -40.37 72.48 Favored 'General case' 0 CA--C 1.509 -0.615 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.805 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . . . . . . . . . 11.8 mt -60.95 -23.73 30.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.448 ' N ' HG11 ' A' ' 130' ' ' VAL . 17.7 tt0 -78.87 -40.69 31.78 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.481 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.5 -46.18 84.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.43 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.07 -39.01 89.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.023 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . 0.402 ' CG1' ' HB1' ' A' ' 128' ' ' ALA . 1.2 mp -60.07 -36.05 65.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.592 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.46 -179.914 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo . . . . . 0 C--O 1.231 0.154 0 CA-C-O 120.771 0.238 . . . . 0.0 112.386 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -85.41 140.91 30.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.634 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 70.4 p -137.24 147.28 45.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.849 0.357 . . . . 0.0 111.191 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -152.55 123.16 1.41 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.356 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 35.0 mt -56.39 102.87 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.829 0.347 . . . . 0.0 111.03 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.63 151.65 29.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.716 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -95.23 146.58 24.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.873 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 14.8 tp -125.03 142.94 51.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.45 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.483 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 19.1 ttp180 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.576 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.483 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.8 m95 . . . . . 0 N--CA 1.462 0.132 0 CA-C-O 120.8 0.333 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -97.97 178.65 5.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.983 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -105.94 129.95 53.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.845 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 32.6 m -144.46 123.51 6.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.358 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.5 tp -69.72 120.96 16.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.503 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -88.12 109.2 19.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.962 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 44.1 t -85.01 84.43 7.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.688 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.434 HD11 HG12 ' A' ' 172' ' ' ILE . 4.1 tp -78.74 125.9 30.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.306 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -129.95 141.65 50.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.928 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -63.03 -14.8 52.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.52 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -101.8 -19.89 15.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.108 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -173.5 172.08 3.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.878 0.37 . . . . 0.0 111.068 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.66 107.86 12.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.809 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -113.69 141.4 47.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.155 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 t -118.41 152.92 20.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.012 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.4 t -149.05 149.93 31.02 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.541 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.69 47.5 1.19 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.582 2.188 . . . . 0.0 112.838 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.134 0 CA-C-O 120.9 0.381 . . . . 0.0 111.408 179.914 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.795 0.331 . . . . 0.0 110.995 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -131.79 82.99 2.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.009 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -82.49 150.87 26.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.961 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 18.7 t -150.37 159.34 4.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.022 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.2 171.54 14.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.048 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -134.63 31.54 3.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.825 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.82 41.91 0.94 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.909 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.5 ttm 178.89 -36.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.939 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.12 -165.96 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.251 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -168.61 137.76 2.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.66 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.475 ' HB ' HG21 ' A' ' 172' ' ' ILE . 2.1 p -110.25 158.89 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.314 0.578 . . . . 0.0 111.484 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.3 m -163.67 151.43 12.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.473 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 11.8 ptt-85 -123.57 91.76 3.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.879 0.371 . . . . 0.0 111.171 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.703 179.653 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.802 0.334 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.29 105.07 7.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.891 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . 0.415 ' HG3' ' CZ ' ' A' ' 156' ' ' PHE . 0.1 OUTLIER -111.0 130.66 55.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.4 ' CD1' ' CD1' ' A' ' 172' ' ' ILE . 24.5 mt -129.98 115.63 34.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.075 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 2.9 m -95.2 136.7 35.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.953 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -116.83 148.58 41.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.175 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.59 30.55 1.98 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.357 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.27 44.51 1.68 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.114 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 118.84 22.2 3.66 Favored Glycine 0 N--CA 1.452 -0.282 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.107 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 58.89 62.05 1.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.123 0.487 . . . . 0.0 110.818 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.63 162.27 15.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.882 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.21 94.21 0.81 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.069 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 32.9 m -87.07 120.23 36.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.328 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.415 ' CZ ' ' HG3' ' A' ' 145' ' ' GLU . 0.3 OUTLIER -104.18 90.03 3.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.75 179.868 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.2 mt -102.75 168.96 8.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.961 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -137.44 103.35 5.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.838 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -57.53 173.49 0.27 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.5 tttp -79.86 -71.41 0.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.989 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -85.08 170.89 12.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.873 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -81.04 -35.56 31.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.948 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -73.33 -40.14 64.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.953 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 168' ' ' TRP . 0.3 OUTLIER -66.11 -41.4 90.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.43 179.718 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -64.76 -42.97 94.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.767 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.9 mtt180 -70.43 -43.97 68.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.225 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -34.53 77.84 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.327 0.584 . . . . 0.0 109.502 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . 0.546 ' O ' HG13 ' A' ' 172' ' ' ILE . 7.4 m95 -68.68 -59.83 2.84 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.595 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . 0.456 ' O ' HG11 ' A' ' 130' ' ' VAL . . . -47.13 -57.61 4.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.161 0.505 . . . . 0.0 110.881 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.46 -39.0 58.97 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.438 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -67.66 -41.61 83.51 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.152 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 168' ' ' TRP . 12.7 mt -62.0 -23.29 31.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 177.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.424 ' N ' HG11 ' A' ' 130' ' ' VAL . 7.0 tt0 -81.17 -28.55 34.95 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.265 179.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.92 -45.12 75.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.375 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -74.87 -34.44 62.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.188 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . 0.409 ' CD1' ' CG2' ' A' ' 172' ' ' ILE . 82.8 mt -85.77 -7.36 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.33 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.362 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.515 179.916 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo . . . . . 0 C--O 1.231 0.146 0 CA-C-O 120.847 0.27 . . . . 0.0 112.272 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -84.15 152.53 24.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.943 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 70.7 p -142.55 142.91 32.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.95 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -150.75 132.0 3.75 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.415 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.4 mt -64.84 119.45 10.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.871 0.367 . . . . 0.0 111.04 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -134.33 158.8 42.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.787 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -92.5 157.75 16.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.969 0.414 . . . . 0.0 110.985 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.4 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 14.3 tp -134.81 130.29 35.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.659 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.489 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 12.9 ttp180 . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.655 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.489 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.7 m95 . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.653 0.263 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -169.28 166.78 10.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.875 0.369 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -90.81 130.5 36.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.853 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.6 m -149.93 125.13 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.367 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 tp -69.8 135.1 49.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.625 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.3 mp -103.93 113.97 27.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.964 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.71 81.14 8.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.766 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.6 tp -73.7 117.08 15.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.105 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.97 138.95 54.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.964 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.88 -23.9 47.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.222 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.33 -31.93 22.74 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.975 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -172.67 174.22 3.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.205 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.2 mt -111.26 115.32 29.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.864 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 63.9 m -120.27 130.74 54.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.841 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.7 t -111.86 159.34 11.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.169 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.0 t -155.65 153.34 26.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.495 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -69.41 50.68 0.73 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.736 2.291 . . . . 0.0 112.695 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.143 0 CA-C-O 120.875 0.369 . . . . 0.0 111.438 179.893 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.05 0 CA-C-O 120.814 0.34 . . . . 0.0 111.089 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.32 159.74 15.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.802 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -147.67 135.28 20.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.881 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 19.7 t -139.68 140.15 37.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.135 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.01 135.74 37.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.832 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 mp -99.19 31.49 3.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.864 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -139.41 38.12 2.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.739 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.3 mtt 179.27 -35.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.063 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.8 -165.97 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.322 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -170.04 113.67 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.665 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.474 ' CG2' ' N ' ' A' ' 131' ' ' SER . 2.0 p -88.14 158.8 3.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.322 0.582 . . . . 0.0 111.439 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 2.6 m -164.65 149.78 9.84 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.801 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 7.0 ptt85 -126.67 104.04 7.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.012 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.753 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.458 -0.055 0 CA-C-O 120.88 0.371 . . . . 0.0 110.949 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.83 138.1 34.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.949 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . 0.418 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.0 OUTLIER -153.66 139.91 18.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.82 179.952 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 24.9 mt -134.1 125.1 47.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.241 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.47 126.18 49.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.78 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -102.78 145.53 29.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.361 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.75 30.65 2.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.171 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -118.61 46.07 1.91 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.38 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.39 23.11 2.69 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.356 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.43 60.66 2.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.126 0.489 . . . . 0.0 110.94 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.16 160.65 16.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.9 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.23 94.03 0.8 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.078 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 6.9 m -89.48 112.67 24.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.246 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.418 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 15.6 m-85 -97.2 115.99 28.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.731 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.4 mt -125.66 165.61 18.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.078 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.447 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.1 OUTLIER -140.43 96.81 3.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.748 179.863 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -57.33 162.88 2.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.203 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.98 -32.23 17.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.924 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -98.13 164.27 12.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.822 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -88.65 -55.8 3.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.91 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.81 85.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.159 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 1.8 t -63.97 -48.16 77.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.79 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -60.12 -38.61 83.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.011 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 74.3 mtp180 -71.12 -47.33 58.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.436 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.06 -28.4 69.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.176 179.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 7.4 m95 -72.44 -52.07 17.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.908 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . 0.406 ' O ' HG13 ' A' ' 130' ' ' VAL . . . -56.9 -47.62 80.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.304 0.573 . . . . 0.0 110.53 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.96 -43.12 97.04 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.64 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.95 -40.72 78.76 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.997 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.43 HG21 ' CD1' ' A' ' 176' ' ' ILE . 19.1 mt -60.21 -24.63 31.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.45 ' N ' HG13 ' A' ' 130' ' ' VAL . 30.6 tt0 -83.84 -27.0 29.03 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.324 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.56 -47.98 68.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.141 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -69.96 -42.09 73.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.86 179.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . 0.43 ' CD1' HG21 ' A' ' 172' ' ' ILE . 75.9 mt -77.57 -8.94 12.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.36 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.361 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.393 179.847 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo . . . . . 0 C--O 1.23 0.122 0 CA-C-O 120.84 0.267 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -101.25 139.18 37.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.952 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.0 p -129.36 167.98 16.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.02 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -167.05 132.75 2.7 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.48 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.5 103.22 0.63 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.762 0.315 . . . . 0.0 110.895 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -120.19 146.69 45.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.811 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -70.64 169.84 13.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.922 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.422 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 37.6 tp -157.57 130.42 7.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.697 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.466 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.635 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.466 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 17.1 m95 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.726 0.298 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -178.09 168.45 1.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.926 0.393 . . . . 0.0 110.844 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -95.09 129.02 42.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.866 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 27.7 m -136.65 138.39 46.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.177 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 17.4 tp -74.33 123.44 24.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.658 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.04 114.49 26.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.108 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -94.47 85.74 4.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.575 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tp -84.93 103.7 14.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.136 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -91.21 155.96 18.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.706 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -57.43 -16.73 10.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.816 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.06 28.95 1.1 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.432 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 179.55 114.75 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.858 0.361 . . . . 0.0 111.514 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.2 tp -95.92 82.44 3.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.397 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.406 HG21 ' CG ' ' A' ' 122' ' ' HIS . 27.6 m -92.49 114.19 26.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.204 -179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.412 ' CG2' ' HB2' ' A' ' 121' ' ' LYS . 8.0 t -83.41 157.35 3.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.675 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -159.9 163.09 23.42 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.906 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.35 147.41 59.0 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.534 2.156 . . . . 0.0 112.133 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.984 179.905 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.845 0.355 . . . . 0.0 111.224 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.412 ' HB2' ' CG2' ' A' ' 41' ' ' VAL . 2.0 mtpp -110.41 74.53 0.88 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.049 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.406 ' CG ' HG21 ' A' ' 40' ' ' THR . 19.6 m-70 -73.05 102.7 3.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.975 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 24.7 t -99.94 115.65 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.965 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 72.1 p -59.74 137.44 58.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.848 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -98.64 53.96 1.03 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.807 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 27.1 mttt -164.45 37.3 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.006 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.51 -39.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.38 . . . . 0.0 110.949 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.15 -169.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.149 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -170.11 123.48 0.71 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.495 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.478 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.5 p -94.66 157.65 3.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.492 0.663 . . . . 0.0 111.615 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.457 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.2 OUTLIER -170.31 127.67 0.83 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.696 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 18.3 ptt-85 -83.26 96.49 8.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.947 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 30.3 mtt180 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.034 -179.751 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 . . . . . 0 N--CA 1.456 -0.153 0 CA-C-O 120.842 0.353 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.0 mt -69.94 94.02 0.82 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.97 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -99.9 123.67 44.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.78 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 22.5 mt -128.81 120.8 53.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.212 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -101.91 129.74 48.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.775 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -110.98 146.46 36.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.192 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.1 30.84 2.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.283 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -114.95 44.92 1.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.062 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.93 20.93 3.3 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.692 -0.686 . . . . 0.0 112.249 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.406 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.5 mm-40 58.69 61.33 2.23 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.066 0.46 . . . . 0.0 110.949 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -92.85 157.96 16.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.682 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -161.15 92.78 0.93 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.225 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.8 m -84.49 127.17 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.032 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -109.21 88.72 2.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.742 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.5 mt -95.95 153.57 17.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.901 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.439 ' CB ' ' CH2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER -127.83 94.02 3.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.841 -179.893 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.24 143.53 44.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.123 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.07 -32.95 51.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.816 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.12 168.6 10.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.848 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -88.72 -61.3 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.878 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -59.7 -31.96 70.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.075 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -49.82 70.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.745 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -60.44 -41.87 94.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.183 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -71.33 -40.38 70.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.545 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 94.4 p -68.59 -33.89 74.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.097 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 7.4 m95 -74.28 -49.1 24.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.839 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -58.57 -49.76 76.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.328 0.585 . . . . 0.0 110.278 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.65 -42.02 96.0 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.425 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.18 -40.68 77.96 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.77 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.45 HG22 ' CD1' ' A' ' 176' ' ' ILE . 11.2 mt -60.33 -24.43 30.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.478 ' N ' HG11 ' A' ' 130' ' ' VAL . 6.3 tp60 -81.43 -29.88 33.7 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.008 -0.997 . . . . 0.0 110.069 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.79 -49.8 71.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.119 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.24 -42.14 84.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.713 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . 0.45 ' CD1' HG22 ' A' ' 172' ' ' ILE . 80.5 mt -76.83 -5.55 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.42 179.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.359 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.454 179.866 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 N--CA 1.464 -0.218 0 CA-C-O 120.805 0.252 . . . . 0.0 112.366 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.4 ttt85 -72.37 141.95 48.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.833 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 77.4 p -143.34 165.13 28.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.978 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 173.8 135.52 2.03 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.421 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.8 mt -68.62 122.36 18.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 0.0 110.935 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -131.91 158.41 41.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.723 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.81 150.95 20.82 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.071 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 7.3 tp -134.29 137.54 44.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.577 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.516 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.82 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.516 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 24.7 m95 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.733 0.302 . . . . 0.0 110.902 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.16 152.54 24.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.065 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.97 135.01 37.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.982 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 33.0 m -148.25 125.75 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.26 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.8 tp -69.8 135.94 50.26 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.596 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -104.53 142.0 35.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.747 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.0 m -123.12 94.53 4.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.884 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HB2' ' CZ3' ' A' ' 168' ' ' TRP . 0.4 OUTLIER -85.55 96.81 9.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.815 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -107.63 137.8 45.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.951 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -57.1 -23.0 43.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.081 0.467 . . . . 0.0 111.226 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 89.9 m-20 -85.11 -31.1 23.52 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -175.79 168.76 3.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.021 0.439 . . . . 0.0 111.315 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -111.0 108.77 18.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.417 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.414 HG21 ' CD2' ' A' ' 122' ' ' HIS . 8.3 m -114.2 139.23 49.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.254 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.8 t -117.46 159.69 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.881 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.1 t -156.34 152.55 23.36 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.708 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.08 47.71 1.06 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.485 2.123 . . . . 0.0 112.485 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.213 0 CA-C-O 121.118 0.485 . . . . 0.0 111.11 -179.771 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.074 0 CA-C-O 120.876 0.37 . . . . 0.0 111.082 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -129.3 91.18 3.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.91 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.414 ' CD2' HG21 ' A' ' 40' ' ' THR . 20.4 m80 -80.22 143.18 33.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.928 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 20.3 t -142.22 140.48 29.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.122 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 1.4 m -76.74 158.52 30.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.936 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -123.18 43.66 2.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.939 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -142.82 35.73 1.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.846 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.25 -36.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.954 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.85 -173.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.316 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -170.04 128.2 0.89 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.682 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.517 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.4 p -105.52 159.52 5.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.321 0.581 . . . . 0.0 111.493 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -165.46 134.22 3.27 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.78 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -99.59 91.88 5.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.098 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.619 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.419 ' CE2' ' HB3' ' A' ' 156' ' ' PHE . 5.1 t80 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.84 0.352 . . . . 0.0 110.991 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -95.6 114.63 26.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.852 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . 0.416 ' HG3' ' CE1' ' A' ' 156' ' ' PHE . 43.3 tt0 -120.78 128.71 53.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.994 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 19.6 mt -132.3 110.03 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.168 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.27 122.54 40.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.806 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -105.45 146.57 29.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.24 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.31 30.47 2.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.261 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -115.06 44.95 1.7 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.076 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.54 23.45 2.58 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.17 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.404 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 6.2 mm-40 56.64 59.23 3.66 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.048 0.451 . . . . 0.0 110.978 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -90.58 160.36 15.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.797 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -165.98 95.45 0.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.159 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 11.1 m -90.1 128.46 42.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.167 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.419 ' HB3' ' CE2' ' A' ' 143' ' ' TYR . 20.9 m-85 -115.93 92.42 3.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.67 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.5 mt -98.61 168.18 10.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.128 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.445 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER -134.14 93.47 3.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.571 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -55.28 168.96 0.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.339 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -84.37 -67.27 0.81 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.959 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -90.28 164.57 14.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.943 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.99 -43.24 79.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.837 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -67.74 -32.54 73.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.077 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 62.2 m -66.28 -50.07 64.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.797 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -62.22 -37.51 85.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.911 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 15.0 ttt180 -72.74 -43.86 62.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.387 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.3 t -65.59 -32.9 74.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.945 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . 0.423 ' CZ3' ' HB2' ' A' ' 34' ' ' LEU . 8.5 m95 -74.16 -53.15 10.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.691 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -58.08 -50.78 72.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.339 0.59 . . . . 0.0 110.388 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.74 -38.38 91.84 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.554 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -71.29 -40.21 71.01 Favored 'General case' 0 CA--C 1.511 -0.545 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.999 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . . . . . . . . . 8.4 mt -62.54 -22.7 30.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.517 ' N ' HG11 ' A' ' 130' ' ' VAL . 26.5 tt0 -77.35 -40.47 43.9 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.434 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.36 -37.53 87.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.471 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -76.81 -33.08 58.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.187 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . . . . . . . . . 48.1 mt -73.75 -28.92 25.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.809 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.37 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.781 179.881 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo . . . . . 0 C--O 1.232 0.195 0 CA-C-O 120.718 0.216 . . . . 0.0 112.234 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.89 152.34 18.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.761 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.9 p -146.13 158.07 43.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.997 0.427 . . . . 0.0 111.219 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -156.11 135.28 4.46 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.266 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 12.9 mt -62.92 106.69 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.778 0.323 . . . . 0.0 110.911 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -117.03 170.07 8.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.865 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -107.68 162.68 13.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.016 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.6 tp -137.1 129.66 30.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.553 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.477 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 37.9 ttp180 . . . . . 0 C--N 1.329 -0.302 0 CA-C-O 120.874 0.369 . . . . 0.0 110.717 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.477 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 29.0 m95 . . . . . 0 N--CA 1.461 0.1 0 CA-C-O 120.924 0.392 . . . . 0.0 111.17 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -148.95 -166.72 2.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.882 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.0 ttp-105 -124.93 110.76 14.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.989 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.6 m -125.35 127.53 72.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.159 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.8 tp -76.04 115.53 15.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.62 121.58 27.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.904 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.7 m -103.61 86.84 2.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.7 tp -78.36 113.35 16.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.819 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.39 148.93 27.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.915 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -64.88 -11.71 40.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.712 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -134.84 16.6 3.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.314 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 179.28 160.04 0.7 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.85 0.357 . . . . 0.0 111.265 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 66.5 tp -124.23 88.71 2.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.557 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.411 HG23 ' CD2' ' A' ' 122' ' ' HIS . 79.4 m -94.29 145.31 24.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.158 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.2 t -125.65 160.21 32.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.019 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 84.5 p -151.9 152.13 29.4 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.539 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -78.93 37.68 0.68 Allowed 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.666 2.244 . . . . 0.0 112.852 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.221 0 CA-C-O 121.076 0.465 . . . . 0.0 111.325 -179.986 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.405 ' O ' ' CE1' ' A' ' 122' ' ' HIS . . . . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.84 0.352 . . . . 0.0 111.047 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.44 160.31 17.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.914 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.411 ' CD2' HG23 ' A' ' 40' ' ' THR . 16.9 m80 -152.27 113.01 4.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.77 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.5 t -119.94 133.63 66.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.144 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 13.1 t -75.46 147.11 40.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.812 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 18.1 mt -104.2 38.08 1.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.043 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -128.59 34.29 4.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.792 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.58 -35.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.009 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.56 -173.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.347 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -170.07 111.29 0.43 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.491 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.468 HG12 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -87.45 159.18 3.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.272 0.558 . . . . 0.0 111.406 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 97.8 p -162.05 149.14 13.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.708 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 27.9 ptt85 -118.69 95.79 4.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.965 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.847 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.805 0.336 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.68 98.24 11.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.77 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -108.39 137.31 46.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.895 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 23.3 mt -137.27 108.81 6.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.144 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.3 m -92.51 135.37 34.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -113.12 144.9 41.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.187 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.55 30.9 1.88 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.304 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -121.44 48.17 1.72 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.129 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.28 18.77 3.68 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.375 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.413 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.8 mm-40 58.64 61.67 2.15 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.096 0.474 . . . . 0.0 111.021 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -89.85 163.81 14.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.8 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.85 96.47 0.44 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.068 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.3 m -97.63 121.76 48.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.169 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 156' ' ' PHE . 0.5 OUTLIER -113.05 106.29 14.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.791 179.802 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -111.92 166.23 11.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.067 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.424 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -129.15 109.96 11.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.868 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -68.83 158.76 33.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.076 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -31.5 24.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.95 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -109.32 160.54 16.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.944 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -74.16 -61.78 1.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -58.99 -27.89 65.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.172 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 45.2 t -66.64 -48.43 69.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.699 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -62.12 -42.51 99.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.973 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 40.7 mtt180 -71.27 -40.81 70.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.449 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 32.6 t -67.66 -34.38 76.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.059 0.457 . . . . 0.0 109.939 179.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . 0.417 ' O ' HG12 ' A' ' 172' ' ' ILE . 12.9 m95 -72.5 -52.49 15.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.67 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . 0.41 ' O ' HG12 ' A' ' 130' ' ' VAL . . . -56.53 -45.98 80.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.171 0.51 . . . . 0.0 110.465 179.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.61 -43.98 95.85 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.518 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.36 -40.8 77.26 Favored 'General case' 0 CA--C 1.511 -0.544 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.611 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.425 HG23 ' CD1' ' A' ' 176' ' ' ILE . 12.9 mm -58.67 -24.81 26.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.468 ' N ' HG12 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -84.12 -28.62 27.36 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.2 179.216 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.42 -40.87 77.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.247 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.14 -41.27 58.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.004 179.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . 0.425 ' CD1' HG23 ' A' ' 172' ' ' ILE . 54.0 mt -79.9 -10.29 12.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.268 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.448 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.367 179.8 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.793 0.247 . . . . 0.0 112.271 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.74 100.31 6.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.869 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 20.7 p -100.65 167.8 10.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.986 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.81 132.05 2.2 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.371 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -59.91 123.46 17.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.864 0.364 . . . . 0.0 110.87 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -136.17 170.13 16.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.801 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -104.29 152.45 22.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.061 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.406 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 26.6 tp -138.71 137.15 36.52 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.564 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.463 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 7.1 ptt180 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.763 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.463 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 18.9 m95 . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.72 0.295 . . . . 0.0 111.026 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -96.06 165.63 12.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.887 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.7 ttp180 -84.68 147.13 27.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.008 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 35.5 m -155.1 144.2 12.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.983 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.9 tp -100.48 124.68 46.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.573 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 mp -89.52 151.27 22.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.915 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.3 t -131.39 98.42 4.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.596 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.89 95.73 9.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.025 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -99.37 142.69 30.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.931 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -59.97 -17.62 39.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.352 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -93.48 -27.87 16.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.974 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -179.94 -170.84 0.16 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.207 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.2 tp -115.47 154.79 28.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.823 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.423 HG21 ' CD2' ' A' ' 122' ' ' HIS . 91.3 m -155.15 140.9 18.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.07 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.9 t -127.61 156.18 39.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.14 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -153.52 167.43 13.59 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.495 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -79.19 45.54 1.96 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.534 2.156 . . . . 0.0 112.749 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.181 0 CA-C-O 121.01 0.433 . . . . 0.0 111.159 179.996 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.783 0.325 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 12.3 mtmm -104.48 90.48 3.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.96 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.423 ' CD2' HG21 ' A' ' 40' ' ' THR . 12.6 m-70 -93.03 116.3 28.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.935 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 4.5 t -90.93 115.97 31.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.893 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 21.2 m -57.05 -28.01 62.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.259 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.3 mp 63.97 -166.94 0.22 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.809 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.1 tttt 63.14 33.44 14.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.815 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.3 ptt? 176.76 -35.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.79 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.6 -175.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.376 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.476 ' CE2' ' CB ' ' A' ' 147' ' ' CYS . 1.0 OUTLIER -162.07 113.96 1.69 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.75 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.489 HG12 ' N ' ' A' ' 173' ' ' GLN . 2.3 p -89.31 159.9 2.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.381 0.61 . . . . 0.0 111.414 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.471 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.4 OUTLIER -165.98 138.28 3.97 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.866 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.02 117.23 29.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.946 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . 0.444 ' CB ' ' CZ ' ' A' ' 143' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.839 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.444 ' CZ ' ' CB ' ' A' ' 133' ' ' ARG . 24.5 p90 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.817 0.341 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.7 mt -92.17 105.57 17.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . 0.419 ' HG3' ' CZ ' ' A' ' 156' ' ' PHE . 0.5 OUTLIER -100.29 115.31 29.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.938 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 28.1 mt -121.1 131.95 71.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.021 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . 0.476 ' CB ' ' CE2' ' A' ' 129' ' ' TYR . 0.8 OUTLIER -120.47 123.41 42.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.972 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -106.22 147.34 29.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.083 0.468 . . . . 0.0 111.175 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.47 30.38 2.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.303 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -112.68 43.65 1.62 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.072 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 122.39 23.84 2.29 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.106 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.412 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 5.9 mm-40 56.71 59.42 3.55 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 120.943 0.401 . . . . 0.0 110.957 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -89.03 149.59 23.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.855 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.22 89.1 1.41 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.996 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 4.7 m -87.12 122.35 38.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.315 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.419 ' CZ ' ' HG3' ' A' ' 145' ' ' GLU . 7.9 m-85 -107.16 97.99 7.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.604 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.4 mt -104.39 162.0 13.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.183 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.438 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -132.97 87.63 2.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.636 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -49.97 172.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.515 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.2 tttm -78.56 -67.13 0.77 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.984 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -98.07 179.27 4.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.927 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.88 -40.87 21.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.887 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.97 94.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.071 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 1.4 m -66.09 -48.04 72.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.575 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -64.54 -34.98 79.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.775 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.11 -45.52 56.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.305 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 53.8 p -63.63 -36.94 85.47 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . 0.512 ' O ' HG12 ' A' ' 172' ' ' ILE . 10.2 m95 -69.23 -57.08 5.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.463 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . 0.42 ' O ' HG12 ' A' ' 130' ' ' VAL . . . -49.5 -57.81 6.35 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.321 0.581 . . . . 0.0 110.715 179.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.42 -38.11 56.99 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.564 -0.743 . . . . 0.0 112.619 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.63 -40.59 76.46 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 120.675 -0.41 . . . . 0.0 111.04 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 168' ' ' TRP . 39.0 mm -60.94 -23.88 31.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 177.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.489 ' N ' HG12 ' A' ' 130' ' ' VAL . 2.2 tt0 -78.01 -37.53 46.89 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.494 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -60.38 -46.83 88.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.614 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 89.2 mm-40 -72.02 -34.2 68.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.188 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . . . . . . . . . 41.9 mt -70.63 -29.24 37.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.688 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.761 179.876 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.852 0.272 . . . . 0.0 112.367 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -80.28 150.93 29.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.832 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 28.0 p -152.61 162.86 40.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.915 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 172.68 133.61 1.68 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.431 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 17.4 mt -63.09 120.1 10.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.783 0.325 . . . . 0.0 110.991 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -127.68 170.12 13.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.416 ' HB3' ' CZ3' ' A' ' 27' ' ' TRP . 3.0 tt0 -103.36 166.55 10.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.976 0.417 . . . . 0.0 111.122 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.402 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 26.1 tp -148.45 126.71 12.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.523 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.466 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 4.4 ptt180 . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.909 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.466 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 31.0 m95 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.809 0.338 . . . . 0.0 110.967 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -153.86 173.62 15.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.937 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -102.17 121.09 41.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.098 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 26.9 m -139.75 121.96 16.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.067 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.01 136.17 50.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.632 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 mp -102.57 159.76 15.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 t -142.11 92.06 2.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.43 HD13 ' CE3' ' A' ' 168' ' ' TRP . 0.6 OUTLIER -79.39 97.38 6.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.858 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -101.01 137.49 39.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.062 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -56.82 -23.09 41.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.115 0.483 . . . . 0.0 111.229 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -86.6 -32.28 20.71 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.778 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -178.15 175.27 1.25 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.175 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.18 131.36 50.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.623 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 70.4 m -131.1 128.41 40.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.942 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.9 t -114.93 159.13 14.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.136 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.6 t -155.64 153.16 25.78 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.552 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.33 45.13 1.15 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.548 2.165 . . . . 0.0 112.822 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.145 0 CA-C-O 120.916 0.388 . . . . 0.0 111.345 179.919 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.9 0.381 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 17.7 mttm -117.76 103.77 10.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.92 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 8.1 m170 -101.56 101.99 12.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.042 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.9 t -90.03 139.43 17.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.868 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.2 p -54.83 -36.98 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.22 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 6.4 tp 62.71 30.71 16.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.003 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -143.85 36.66 1.29 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.41 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 177.27 -30.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.8 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.403 ' HB2' ' HA ' ' A' ' 148' ' ' ALA . . . -55.3 -166.64 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.23 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -165.89 122.39 1.36 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.656 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.476 HG13 ' N ' ' A' ' 173' ' ' GLN . 2.8 p -99.28 159.97 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.399 0.619 . . . . 0.0 111.657 -179.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 4.5 p -160.81 154.58 22.42 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.562 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.66 100.14 5.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.905 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.849 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.82 0.343 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.21 153.21 27.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.834 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . 0.41 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.1 tt0 -158.77 137.78 11.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 4.5 mp -141.65 120.82 10.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.053 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 16.3 m -100.95 139.58 36.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.851 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . 0.403 ' HA ' ' HB2' ' A' ' 128' ' ' ALA . . . -106.7 149.08 27.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.425 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.73 30.3 2.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.215 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -121.73 48.49 1.69 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.071 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.58 18.81 3.93 Favored Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.123 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.424 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 3.3 mm-40 58.97 61.48 2.13 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.086 0.47 . . . . 0.0 111.005 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.5 165.54 15.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.552 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.96 96.56 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.219 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.8 m -91.85 127.09 44.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.266 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.41 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 0.2 OUTLIER -107.48 117.35 33.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.668 179.787 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -124.72 161.3 26.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.029 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.439 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -127.31 112.77 15.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.842 -179.903 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -71.05 172.92 8.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.094 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -80.77 -66.47 0.88 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.929 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -103.0 -178.36 3.64 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.886 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -75.84 -49.45 17.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.964 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -60.37 -36.69 78.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.151 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 66.3 m -67.62 -44.21 78.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.761 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.96 -37.9 85.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.809 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -73.68 -41.74 62.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.316 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 3.7 m -65.77 -32.73 74.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.924 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . 0.43 ' CE3' HD13 ' A' ' 34' ' ' LEU . 11.3 m95 -75.76 -54.88 6.25 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.57 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -57.44 -47.29 82.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.323 0.583 . . . . 0.0 110.407 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -60.46 -41.72 98.73 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.638 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.7 -40.19 73.0 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.855 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.448 HG23 ' CD1' ' A' ' 176' ' ' ILE . 17.3 mt -60.88 -24.39 32.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.476 ' N ' HG13 ' A' ' 130' ' ' VAL . 17.8 tt0 -80.61 -31.67 36.56 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.229 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -62.36 -48.83 78.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.241 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -67.89 -40.77 83.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.773 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . 0.448 ' CD1' HG23 ' A' ' 172' ' ' ILE . 81.9 mt -77.6 -4.77 6.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.414 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.355 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.896 179.844 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo . . . . . 0 C--O 1.23 0.095 0 CA-C-O 120.914 0.298 . . . . 0.0 112.237 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.6 ttt85 -93.49 129.62 39.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.488 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.6 p -137.59 140.77 41.17 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.929 0.395 . . . . 0.0 111.198 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.18 135.1 6.25 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.367 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.3 mt -58.64 108.17 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.936 0.398 . . . . 0.0 111.006 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.87 164.79 14.91 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.755 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -102.96 155.54 18.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.946 0.403 . . . . 0.0 111.019 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 5.8 tp -133.96 135.17 43.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.614 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.477 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 31.0 ttp180 . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.803 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.477 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 45.1 m95 . . . . . 0 CA--C 1.529 0.14 0 CA-C-O 120.759 0.314 . . . . 0.0 111.168 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -154.59 -172.42 4.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.945 0.403 . . . . 0.0 111.058 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -109.7 121.84 46.13 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.048 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 30.6 m -140.51 124.28 17.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.094 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tp -69.72 120.86 16.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.567 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.5 tp -89.08 116.35 27.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.017 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.58 89.36 4.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.676 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 tp -89.15 123.99 33.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.003 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -134.5 149.21 50.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.027 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.4 -16.87 50.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.46 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -92.32 -27.02 17.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.013 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -178.58 176.75 0.97 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.047 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.33 95.6 4.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.844 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.404 HG23 ' CD2' ' A' ' 122' ' ' HIS . 60.5 m -102.69 130.24 49.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.984 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 9.8 t -100.72 157.64 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.06 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.8 p -147.33 154.15 45.23 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.603 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.43 40.51 0.85 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.592 2.195 . . . . 0.0 112.779 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.218 0 CA-C-O 121.191 0.52 . . . . 0.0 111.015 -179.973 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.81 0.338 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 12.6 mttm -106.81 81.08 1.52 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.008 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.404 ' CD2' HG23 ' A' ' 40' ' ' THR . 15.9 m-70 -72.24 93.63 1.49 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.873 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.5 t -88.2 111.21 22.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.207 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.29 129.06 38.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.844 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.3 mp -88.9 -170.02 2.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.031 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.29 38.5 16.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.773 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.88 -38.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.858 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.73 -169.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.205 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -162.19 115.04 1.74 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.471 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.494 HG11 ' N ' ' A' ' 173' ' ' GLN . 7.1 p -91.0 162.42 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.479 0.657 . . . . 0.0 111.793 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.455 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.1 m -165.35 141.41 5.39 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.492 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 19.7 ptt85 -107.76 115.31 29.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.953 0.406 . . . . 0.0 111.043 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . 0.466 ' O ' ' N ' ' A' ' 143' ' ' TYR . 2.8 mtp180 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.595 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.466 ' N ' ' O ' ' A' ' 133' ' ' ARG . 19.3 t80 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.816 0.341 . . . . 0.0 110.946 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.11 108.77 12.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.712 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -111.88 144.13 41.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 19.6 mt -139.1 126.03 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.066 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.8 p -111.65 117.83 33.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -98.61 146.34 25.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.236 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.05 31.68 2.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.237 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -115.33 44.62 1.8 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.33 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.56 24.21 2.42 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.484 -179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.33 60.09 2.76 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.985 0.421 . . . . 0.0 110.969 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.7 151.98 20.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.739 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -155.05 90.0 1.25 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.247 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 10.4 m -89.21 127.58 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.075 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.78 117.23 31.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.918 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.1 mp -126.62 168.69 13.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.417 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 1.7 ttp85 -142.32 118.2 10.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.954 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -78.05 172.67 13.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.037 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.99 -31.79 12.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -106.41 140.17 39.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.926 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -66.37 -42.85 87.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.085 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.88 -46.11 75.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.067 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.47 -49.53 77.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.62 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -58.25 -38.93 77.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.139 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.6 ttt-85 -69.7 -47.79 61.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.532 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.64 -30.81 71.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.022 0.439 . . . . 0.0 110.249 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -72.13 -48.95 39.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.972 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -57.87 -54.55 45.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.283 0.564 . . . . 0.0 110.545 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.64 -36.96 80.98 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.642 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -72.84 -39.57 66.46 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 120.966 0.413 . . . . 0.0 110.615 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.447 HG22 ' CD1' ' A' ' 176' ' ' ILE . 11.9 mt -61.94 -22.74 29.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.494 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.7 OUTLIER -77.96 -44.77 25.79 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.532 179.644 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.82 -33.94 77.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.591 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.45 -29.84 41.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.981 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . 0.447 ' CD1' HG22 ' A' ' 172' ' ' ILE . 6.1 mt -68.04 -28.93 42.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.53 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.334 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.685 179.793 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo . . . . . 0 C--O 1.231 0.133 0 CA-C-O 120.846 0.269 . . . . 0.0 112.278 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.7 153.5 22.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.683 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 28.6 p -140.35 161.37 37.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.06 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -161.31 126.49 1.59 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.414 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.9 mt -60.32 110.46 1.25 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.744 0.307 . . . . 0.0 110.936 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -121.45 132.54 54.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.87 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.37 149.6 47.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.818 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 58.0 tp -125.51 139.69 53.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.772 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.465 ' HA ' ' CD2' ' A' ' 27' ' ' TRP . 6.1 ttm180 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.445 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.465 ' CD2' ' HA ' ' A' ' 15' ' ' ARG . 28.0 m95 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.819 0.342 . . . . 0.0 110.86 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -102.11 -173.35 2.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.972 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.15 128.03 56.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.897 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.5 m -143.62 122.95 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.172 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tp -69.82 137.01 51.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.576 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 mp -106.81 109.92 21.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.14 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 m -85.14 88.17 7.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.604 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 tp -79.76 131.36 35.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.191 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.59 145.51 38.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.913 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.46 -15.15 48.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.447 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -96.29 -24.02 16.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.046 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -177.42 -178.68 0.78 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 0.0 111.153 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 30.4 tp -128.32 102.88 6.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.722 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 58.5 m -102.91 136.39 42.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.031 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.7 t -109.25 159.33 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.101 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.9 t -160.08 149.29 14.1 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.495 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.17 46.92 1.66 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.622 2.215 . . . . 0.0 112.907 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.211 0 CA-C-O 120.972 0.415 . . . . 0.0 111.244 179.853 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.868 0.366 . . . . 0.0 111.023 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -101.33 88.88 3.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.054 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -76.69 109.01 10.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.932 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.5 t -109.89 150.84 12.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.102 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 87.1 p -87.48 157.24 19.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.906 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.5 tp -120.67 31.75 6.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.923 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -133.39 38.38 3.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.707 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.4 mtt 177.6 -34.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.874 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.0 -171.53 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.988 0.423 . . . . 0.0 111.31 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -168.44 116.56 0.7 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.434 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.467 ' CG2' ' N ' ' A' ' 131' ' ' SER . 1.9 p -88.04 158.47 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.314 0.578 . . . . 0.0 111.579 -179.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.467 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 93.6 p -168.48 159.2 10.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.756 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 16.8 ptt85 -132.89 126.59 32.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.042 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.804 179.775 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.41 ' CD2' ' HD3' ' A' ' 158' ' ' ARG . 58.3 m-85 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.851 0.358 . . . . 0.0 110.942 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.402 ' CD2' ' CB ' ' A' ' 169' ' ' ALA . 0.3 OUTLIER -84.96 112.67 20.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.71 179.888 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . 0.416 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.8 tt0 -108.12 131.23 54.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.986 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 35.6 mt -132.32 110.98 17.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.189 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 30.7 p -91.66 155.36 18.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.908 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -132.89 145.83 51.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.105 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.54 30.51 1.98 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.289 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -119.41 47.04 1.77 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.171 0.51 . . . . 0.0 110.115 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.23 17.06 4.57 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.266 -179.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 61.11 63.95 1.18 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.049 0.452 . . . . 0.0 110.91 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -91.07 162.69 14.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.818 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.28 96.04 0.48 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.157 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 9.4 m -90.63 124.97 43.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.199 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.416 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 0.5 OUTLIER -105.96 87.13 2.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.807 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.2 mt -99.86 171.25 7.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.98 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.41 ' HD3' ' CD2' ' A' ' 143' ' ' TYR . 6.5 ttp85 -143.58 116.33 8.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -70.84 172.87 8.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.205 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.74 -31.38 13.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.009 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -110.89 157.52 19.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.868 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -73.83 -57.12 4.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.851 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -61.08 -32.45 72.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.075 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 2.9 m -64.62 -52.58 56.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.8 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.89 77.35 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.051 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -45.23 60.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.365 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 59.8 p -66.52 -32.4 73.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.1 179.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 7.1 m95 -72.56 -49.88 29.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.743 179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . 0.402 ' CB ' ' CD2' ' A' ' 144' ' ' LEU . . . -58.92 -47.33 85.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.314 0.578 . . . . 0.0 110.385 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -59.7 -40.89 97.13 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.525 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.91 -40.29 72.24 Favored 'General case' 0 CA--C 1.51 -0.592 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.894 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.423 HG22 ' CD1' ' A' ' 176' ' ' ILE . 10.9 mt -60.98 -24.51 33.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 177.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.437 ' N ' HG13 ' A' ' 130' ' ' VAL . 19.5 tt0 -85.3 -25.91 26.91 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.507 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.83 -42.49 73.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.196 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -76.01 -39.99 54.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.814 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . 0.423 ' CD1' HG22 ' A' ' 172' ' ' ILE . 67.4 mt -80.7 -9.46 12.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.362 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.287 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.449 179.859 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo . . . . . 0 C--O 1.232 0.225 0 CA-C-O 120.916 0.298 . . . . 0.0 112.45 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -86.26 136.63 33.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.697 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 34.0 p -136.45 148.39 47.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.954 0.407 . . . . 0.0 111.35 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.26 162.36 30.15 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.194 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.3 mt -82.98 132.93 35.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.791 0.329 . . . . 0.0 110.989 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -146.87 145.52 29.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.738 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -79.84 158.33 26.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.104 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 12.6 tp -141.89 128.97 20.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.411 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.468 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 29.5 ttp180 . . . . . 0 C--N 1.331 -0.228 0 CA-C-O 120.894 0.378 . . . . 0.0 110.904 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.468 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 39.6 m95 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.767 0.318 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -160.74 152.66 19.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.959 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.54 120.14 22.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.921 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 33.3 m -130.1 133.86 63.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.062 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 12.0 tp -74.7 143.34 44.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.758 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.33 137.03 49.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.957 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.56 94.4 4.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.799 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.424 ' HA ' ' CD2' ' A' ' 39' ' ' LEU . 7.6 tp -89.31 115.3 26.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.962 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -117.89 149.11 41.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.702 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.82 -15.54 31.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.31 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -95.29 -26.85 15.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.236 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 179.05 171.65 0.86 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.806 0.336 . . . . 0.0 111.302 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.424 ' CD2' ' HA ' ' A' ' 34' ' ' LEU . 3.2 tm? -106.25 115.42 30.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.709 179.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.8 m -116.72 123.38 47.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.15 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.9 t -103.81 159.58 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.894 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -167.34 166.47 8.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.783 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -64.52 148.26 90.54 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.577 2.185 . . . . 0.0 112.259 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.054 179.921 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.41 ' HB2' ' CD2' ' A' ' 122' ' ' HIS . . . . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 120.822 0.344 . . . . 0.0 111.106 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -105.52 92.55 4.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.834 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.41 ' CD2' ' HB2' ' A' ' 120' ' ' ALA . 7.3 m-70 -93.77 109.49 21.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.198 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -116.55 121.83 68.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.762 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 10.6 t -56.57 140.09 47.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.826 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.411 ' CD2' ' HB3' ' A' ' 175' ' ' GLN . 1.9 mp -97.39 31.11 2.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.981 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 mtmm -133.65 32.18 3.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.531 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.55 -36.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.83 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.94 -172.34 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.172 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -168.77 120.65 0.78 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.843 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.469 HG12 ' N ' ' A' ' 173' ' ' GLN . 2.0 p -94.38 159.12 2.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.196 0.522 . . . . 0.0 111.123 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.468 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 13.6 t -164.46 155.11 14.85 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.846 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 21.2 ttp180 -121.52 84.04 2.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.642 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.899 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 1.5 t80 . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.926 0.393 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -96.79 119.61 35.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.695 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . 0.423 ' HG3' ' CE1' ' A' ' 156' ' ' PHE . 9.0 tt0 -125.81 138.22 53.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.066 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 14.2 mt -134.95 112.8 15.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.073 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 18.5 m -88.48 162.07 16.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.03 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -144.09 146.51 32.86 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.171 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.03 30.24 2.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.337 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.22 45.47 1.76 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.131 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 117.05 23.01 4.03 Favored Glycine 0 N--CA 1.449 -0.459 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.14 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 58.78 61.93 2.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 121.096 0.474 . . . . 0.0 110.84 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -88.66 161.95 16.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.883 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -168.38 89.82 0.26 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.144 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 30.2 m -77.5 132.89 31.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.127 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.423 ' CE1' ' HG3' ' A' ' 145' ' ' GLU . 68.0 m-85 -111.03 92.04 3.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.647 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.8 mt -104.04 160.19 15.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.19 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.456 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 2.9 ttt180 -133.38 97.17 3.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.828 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -54.34 171.28 0.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.247 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.85 -31.05 11.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.841 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -108.36 171.53 7.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.861 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.27 -55.65 3.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.967 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.41 -28.17 68.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.206 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -52.27 37.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.7 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.47 -37.43 83.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.949 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -73.19 -44.04 60.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.311 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 24.8 t -66.42 -33.24 75.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.874 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . 0.417 ' O ' HG12 ' A' ' 172' ' ' ILE . 11.5 m95 -72.5 -52.49 15.49 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.75 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -56.24 -45.87 79.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.291 0.567 . . . . 0.0 110.467 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.9 -44.54 96.01 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.527 -0.761 . . . . 0.0 112.734 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.09 -40.81 82.57 Favored 'General case' 0 CA--C 1.51 -0.571 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.176 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.417 HG12 ' O ' ' A' ' 168' ' ' TRP . 20.8 mm -60.4 -24.91 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.469 ' N ' HG12 ' A' ' 130' ' ' VAL . 30.8 tt0 -83.63 -26.15 30.18 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.571 179.416 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.66 -49.31 63.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.21 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . 0.411 ' HB3' ' CD2' ' A' ' 125' ' ' LEU . 1.9 mp0 -69.65 -41.26 75.82 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.787 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . 0.413 ' CD1' HG23 ' A' ' 172' ' ' ILE . 67.5 mt -80.05 -3.03 5.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.378 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 0.419 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.643 179.905 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo . . . . . 0 N--CA 1.466 -0.125 0 CA-C-O 120.857 0.274 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.44 146.19 36.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.786 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 58.8 p -140.44 152.95 46.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.095 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -158.63 123.9 1.31 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.328 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 18.4 mt -64.28 100.73 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.875 0.369 . . . . 0.0 110.926 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.61 170.03 8.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.895 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.88 155.97 19.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.979 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 13.2 tp -134.37 127.8 32.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.638 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.436 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.7 OUTLIER . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.852 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.463 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 46.6 m95 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.801 0.334 . . . . 0.0 110.962 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -147.39 152.61 38.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.018 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -80.63 121.32 25.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.041 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 31.9 m -134.52 137.82 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.135 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tp -86.16 127.8 34.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.616 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.16 103.44 14.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.015 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 m -82.24 78.57 8.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.657 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.424 HD21 ' CZ3' ' A' ' 168' ' ' TRP . 3.6 tp -74.48 93.29 2.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.17 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.46 147.8 22.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.916 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.2 -14.76 52.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.512 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.41 -17.33 14.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.237 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -174.23 173.71 3.02 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.78 0.324 . . . . 0.0 111.128 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.37 104.63 9.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.895 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.444 ' CG2' ' CD2' ' A' ' 122' ' ' HIS . 21.3 m -101.45 155.03 18.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.041 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.2 t -138.78 159.11 30.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.147 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.19 158.33 13.92 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.542 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -73.85 42.02 0.68 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.768 2.312 . . . . 0.0 112.78 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.159 0 CA-C-O 121.032 0.444 . . . . 0.0 111.302 179.923 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.423 ' HB1' ' CE1' ' A' ' 122' ' ' HIS . . . . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.82 0.343 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.5 tttp -84.47 95.28 8.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.767 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.444 ' CD2' ' CG2' ' A' ' 40' ' ' THR . 73.3 m80 -91.16 103.11 15.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.089 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 6.6 t -81.81 118.06 28.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.725 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -49.25 -34.55 15.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.516 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.8 tp 60.22 -165.21 0.21 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.665 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 54.88 38.78 30.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.991 0.424 . . . . 0.0 110.773 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.7 mtt 173.42 -30.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.762 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.06 -167.75 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.296 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.448 ' CD1' ' N ' ' A' ' 129' ' ' TYR . 0.0 OUTLIER -159.77 120.13 3.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.62 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.465 ' CG2' ' N ' ' A' ' 131' ' ' SER . 2.4 p -94.52 159.53 2.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.31 0.576 . . . . 0.0 111.272 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.0 OUTLIER -169.1 125.46 0.92 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.862 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 -95.89 86.65 4.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.967 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.881 179.867 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.775 0.321 . . . . 0.0 110.849 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.17 109.2 21.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.734 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -114.36 142.32 46.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 24.0 mt -146.31 107.18 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 11.7 m -92.77 133.38 36.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.052 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -108.5 150.21 27.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.406 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.24 30.69 2.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.294 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -116.3 45.78 1.71 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.075 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.22 23.49 3.2 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.145 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.408 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.5 mm-40 57.16 59.59 3.34 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.07 0.462 . . . . 0.0 111.084 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -85.74 158.61 19.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.545 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -157.98 91.66 1.13 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.206 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 6.6 m -92.02 117.87 36.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.219 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -110.26 83.18 1.71 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.778 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.3 mt -90.35 166.58 13.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.034 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.44 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 24.0 ttp180 -131.28 105.9 7.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.793 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -56.67 170.13 0.42 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.271 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.76 -30.49 20.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.988 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -119.11 168.87 10.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.931 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -78.02 -57.37 3.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.872 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -58.77 -35.38 72.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.173 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 168' ' ' TRP . 16.8 p -61.33 -51.89 66.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.919 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -58.67 -39.03 79.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.191 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.21 -45.42 66.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.716 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 4.9 m -67.42 -32.58 73.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.007 0.432 . . . . 0.0 110.254 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . 0.424 ' CZ3' HD21 ' A' ' 34' ' ' LEU . 5.1 m95 -72.98 -47.86 41.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.828 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . 0.449 ' O ' HG13 ' A' ' 130' ' ' VAL . . . -56.79 -58.57 7.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.315 0.579 . . . . 0.0 110.164 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.31 -40.13 60.11 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.558 -0.747 . . . . 0.0 112.588 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.35 -41.02 81.31 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.791 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.409 HG22 ' CD1' ' A' ' 176' ' ' ILE . 10.8 mt -59.64 -24.0 27.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 177.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -77.39 -37.57 51.73 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.013 179.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -59.35 -47.68 84.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.538 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -37.29 77.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.063 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . 0.44 HD13 HG12 ' A' ' 130' ' ' VAL . 49.3 mt -68.29 -29.15 43.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.039 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 0.254 0 C-N-CA 120.398 -0.906 . . . . 0.0 112.936 179.851 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo . . . . . 0 C--O 1.23 0.118 0 CA-C-O 120.854 0.273 . . . . 0.0 112.375 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -93.83 142.24 27.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.823 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 38.1 p -140.77 161.61 37.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.943 0.402 . . . . 0.0 111.213 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.56 140.41 5.55 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.356 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 26.8 mt -61.14 120.72 10.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.927 0.394 . . . . 0.0 110.959 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.78 154.94 49.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.743 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.54 160.25 20.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.905 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.433 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 46.1 tp -141.31 126.44 18.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.632 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.43 ' CG ' ' NE1' ' A' ' 27' ' ' TRP . 2.4 ttm180 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.618 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.433 ' CE3' ' C ' ' A' ' 14' ' ' LEU . 31.3 m95 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.659 0.266 . . . . 0.0 110.755 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.51 168.71 26.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.839 0.352 . . . . 0.0 111.068 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 -92.24 137.01 32.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.975 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.404 ' HB ' ' O ' ' A' ' 42' ' ' SER . 29.3 m -156.44 120.77 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.021 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.2 tp -69.73 128.24 35.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.703 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.5 mp -92.98 139.73 30.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.99 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 t -113.48 77.43 1.05 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.681 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.5 tp -72.99 96.25 2.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.86 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -96.29 148.09 23.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.905 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.26 -13.45 38.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.511 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -103.45 -19.03 14.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.391 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -176.2 174.42 2.02 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.968 0.413 . . . . 0.0 111.38 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -112.94 93.94 4.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.67 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.8 m -98.99 134.74 41.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.94 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 13.1 t -106.27 158.59 6.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.98 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.404 ' O ' ' HB ' ' A' ' 30' ' ' VAL . 14.9 p -146.56 152.12 44.7 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.787 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.72 44.48 1.43 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.611 2.207 . . . . 0.0 112.688 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.194 0 CA-C-O 121.097 0.475 . . . . 0.0 111.188 -179.941 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.809 0.338 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 44.8 tttp -105.38 84.74 2.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.89 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 10.5 m-70 -73.84 92.21 2.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.866 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 27.4 t -85.97 120.44 35.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.171 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 1.7 m -68.53 131.85 45.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.88 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.2 mp -87.88 -168.19 2.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.857 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.07 32.69 17.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.761 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 3.2 mtt -171.04 -41.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.001 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.23 -169.69 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.138 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -170.2 122.88 0.68 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.472 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.498 HG13 ' N ' ' A' ' 173' ' ' GLN . 2.3 p -96.45 158.8 3.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.342 0.591 . . . . 0.0 111.539 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.464 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 15.8 m -151.93 166.4 31.61 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.645 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.2 ttp180 -134.04 85.8 2.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.062 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.872 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.85 0.357 . . . . 0.0 110.879 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -111.6 115.14 28.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.581 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -117.66 136.46 53.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.055 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 28.7 mt -135.94 104.24 4.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.978 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 29.7 m -90.1 136.42 33.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.957 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -114.65 150.8 34.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.041 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.06 30.92 1.76 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.5 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -110.67 42.81 1.52 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.035 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.68 25.71 2.54 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.118 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.411 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 5.8 mm-40 56.75 59.42 3.54 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.035 0.445 . . . . 0.0 110.934 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -94.08 162.75 13.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.805 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.39 93.42 0.85 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.182 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 6.6 m -83.23 128.31 38.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.13 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.423 ' CE1' ' HB3' ' A' ' 15' ' ' ARG . 0.2 OUTLIER -109.12 93.11 4.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.751 -179.91 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.3 mp -96.71 167.52 11.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.077 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.425 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -130.75 112.81 13.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.811 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -67.56 172.13 5.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.14 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -85.59 -66.05 0.94 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.024 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -97.96 170.86 8.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.881 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.01 -47.44 58.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.032 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.25 -38.4 90.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.139 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 30.4 t -61.75 -47.66 84.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.868 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -60.47 -41.2 93.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.224 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 51.9 mtp180 -70.08 -44.06 69.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.543 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.3 -34.32 77.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.054 179.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . 0.415 ' O ' HG13 ' A' ' 172' ' ' ILE . 11.2 m95 -74.26 -50.86 17.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.834 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -56.23 -51.58 67.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.399 0.619 . . . . 0.0 110.491 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.94 -40.81 95.82 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.798 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.21 -41.09 77.55 Favored 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.355 -179.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.438 HG21 ' HB ' ' A' ' 130' ' ' VAL . 6.8 mt -62.65 -23.18 31.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.498 ' N ' HG13 ' A' ' 130' ' ' VAL . 54.2 tt0 -80.66 -30.52 36.55 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.315 179.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.57 -47.34 76.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.338 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -70.55 -39.37 74.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.998 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . 0.412 ' CD1' HG23 ' A' ' 172' ' ' ILE . 84.5 mt -78.11 -9.95 12.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.195 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.448 179.88 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo . . . . . 0 N--CA 1.465 -0.153 0 CA-C-O 120.794 0.247 . . . . 0.0 112.306 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.63 155.76 25.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.813 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 74.6 p -144.35 138.12 27.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.968 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -136.72 121.62 2.41 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.435 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.0 mt -68.53 114.09 6.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.876 0.37 . . . . 0.0 110.921 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.21 150.24 50.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.72 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -83.58 163.22 20.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.036 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 39.6 tp -130.95 126.63 36.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.636 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.478 ' HA ' ' CD2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.63 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.478 ' CD2' ' HA ' ' A' ' 15' ' ' ARG . 22.1 m95 . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.709 0.29 . . . . 0.0 110.655 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -146.47 -175.02 4.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.994 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -109.98 137.34 47.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 26.2 m -151.19 128.02 2.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.12 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.2 tp -81.98 127.23 32.85 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.424 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -94.16 92.78 7.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.104 -179.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.15 89.22 1.49 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.579 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.6 tp -84.65 119.86 25.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.152 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -122.83 138.8 54.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.022 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -56.77 -23.2 41.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.462 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -89.55 -29.95 18.56 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.006 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -175.72 166.82 3.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.135 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.56 152.93 21.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.752 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 88.3 m -158.21 132.64 8.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.772 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.7 t -117.86 159.26 18.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.214 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -155.31 176.27 2.64 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.539 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -82.25 38.52 0.75 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.531 2.154 . . . . 0.0 112.841 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.261 0 CA-C-O 121.116 0.484 . . . . 0.0 111.07 179.964 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.787 0.327 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -101.4 97.72 8.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.88 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -88.94 113.94 25.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.961 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.7 t -103.18 137.92 29.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.085 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.27 159.79 30.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.868 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -123.6 34.36 5.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.974 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.29 34.84 1.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.964 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 3.3 ptp 178.55 -37.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.0 -177.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.324 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -159.23 124.36 4.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.461 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.506 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.9 p -101.27 159.95 3.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.318 0.58 . . . . 0.0 111.497 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.461 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -161.45 156.13 23.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.994 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.65 139.72 53.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.772 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.793 -179.98 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.836 0.351 . . . . 0.0 111.057 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.2 mt -94.23 116.14 28.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.753 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -108.98 130.29 55.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.87 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 35.6 mt -132.91 120.72 42.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.097 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 35.8 t -109.78 124.27 50.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.777 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -108.53 147.51 31.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.21 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.47 30.74 2.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.179 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -112.09 42.75 1.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.404 179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.68 25.28 2.17 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.955 -0.641 . . . . 0.0 112.359 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.56 60.55 2.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.068 0.461 . . . . 0.0 110.923 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -93.31 148.38 22.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.861 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -155.64 90.41 1.24 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.092 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 27.2 m -88.94 131.2 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.21 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -118.0 96.29 5.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.68 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -103.28 167.06 10.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.041 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.432 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 69.2 ttt180 -132.8 101.16 5.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.719 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.85 173.49 0.43 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.158 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.06 -33.27 10.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.935 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.03 -170.01 1.78 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.822 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -108.21 -56.66 2.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.71 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.39 -29.91 70.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.872 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 3.4 m -65.25 -47.48 76.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.504 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.54 -46.05 91.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.026 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -69.64 -37.91 76.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.518 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 88.5 p -70.01 -34.21 73.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.167 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 6.9 m95 -73.06 -48.88 32.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.865 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . 0.424 ' HA ' HG21 ' A' ' 130' ' ' VAL . . . -57.3 -51.82 67.82 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.359 0.599 . . . . 0.0 110.486 179.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.82 -40.87 93.62 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.748 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.96 76.39 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.049 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . . . . . . . . . 9.5 mt -61.62 -22.83 29.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.506 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -71.11 -55.53 8.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.477 179.239 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -52.73 -37.74 59.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.119 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.43 -30.46 57.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.311 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . . . . . . . . . 19.4 mt -71.33 -25.91 25.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.913 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.336 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.788 179.593 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo . . . . . 0 C--O 1.231 0.14 0 CA-C-O 120.794 0.247 . . . . 0.0 112.452 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -97.56 143.42 28.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.977 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.0 p -141.44 154.6 45.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.938 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -159.6 135.79 4.3 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.535 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 66.4 mt -66.56 105.3 1.47 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.806 0.336 . . . . 0.0 110.989 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -116.26 152.34 34.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.819 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.427 ' HB3' ' CE3' ' A' ' 27' ' ' TRP . 4.5 tt0 -78.93 170.11 17.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.878 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.407 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 39.7 tp -145.33 120.81 10.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.74 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.468 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.453 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.468 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 21.7 m95 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.792 0.33 . . . . 0.0 110.776 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.56 175.88 5.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.88 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -105.62 127.03 52.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.958 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.4 m -141.46 130.26 23.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.109 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.7 tp -73.5 124.9 26.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.751 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.9 tp -92.39 125.38 37.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.972 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.14 87.89 3.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.78 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.427 ' CD1' ' CD1' ' A' ' 172' ' ' ILE . 4.8 tp -84.09 123.14 29.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.015 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -134.28 139.77 45.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.016 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.36 -23.53 49.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.103 0.478 . . . . 0.0 111.278 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -83.77 -31.17 26.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.89 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -174.62 169.1 3.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.262 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.76 106.58 14.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.723 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.405 HG21 ' CD2' ' A' ' 122' ' ' HIS . 28.0 m -115.7 132.04 56.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.997 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 17.6 t -106.24 160.15 5.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.921 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.44 167.17 9.62 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.764 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.63 148.45 65.93 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.571 2.181 . . . . 0.0 112.267 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.004 -179.975 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.768 0.318 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.06 78.03 1.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.861 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.405 ' CD2' HG21 ' A' ' 40' ' ' THR . 20.4 m-70 -71.46 146.75 48.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.057 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.4 t -149.45 113.29 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.067 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.18 147.73 52.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.064 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -98.31 -176.95 3.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.741 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 67.62 45.41 1.5 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.989 0.423 . . . . 0.0 110.95 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 178.45 -37.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.768 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.09 -176.57 0.72 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.173 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.455 ' CE1' ' HB3' ' A' ' 147' ' ' CYS . 53.3 p90 -162.23 115.15 1.74 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.807 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.473 ' CG2' ' N ' ' A' ' 131' ' ' SER . 1.6 p -78.78 158.92 4.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.274 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.473 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.9 OUTLIER -164.59 119.04 1.38 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.672 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 17.0 ptt-85 -94.05 86.35 4.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.866 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 10.0 mtt85 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.869 179.839 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.746 0.308 . . . . 0.0 110.758 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.3 mt -84.94 86.15 7.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.638 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.41 131.41 53.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.902 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 28.8 mt -126.87 137.38 58.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.082 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . 0.455 ' HB3' ' CE1' ' A' ' 129' ' ' TYR . 0.8 OUTLIER -107.17 158.9 16.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.83 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -136.86 144.07 43.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.204 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.73 31.16 2.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.234 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -116.44 44.88 1.9 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.457 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.74 23.22 3.12 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.432 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 59.62 62.0 1.84 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.034 0.445 . . . . 0.0 110.798 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -94.76 156.42 16.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.814 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.82 93.64 0.82 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.152 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.2 m -83.19 130.13 36.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.162 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -106.56 89.56 3.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.837 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.3 mt -105.39 155.98 18.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.046 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.422 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 13.6 ttm180 -127.01 112.37 15.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.792 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -57.88 173.51 0.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.124 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.91 -31.11 11.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.99 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.92 -179.59 3.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -87.63 -59.16 2.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.875 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -62.24 -33.25 74.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.128 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.89 -44.86 84.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.753 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -64.37 -43.56 94.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.022 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.78 -41.07 75.61 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.158 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 60.5 p -65.32 -40.67 94.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . 0.555 ' O ' HG12 ' A' ' 172' ' ' ILE . 8.7 m95 -66.52 -55.59 14.83 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.505 179.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -46.02 -64.99 0.61 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.19 0.519 . . . . 0.0 110.897 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -49.7 -36.77 26.13 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.105 179.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.0 -40.35 78.77 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.968 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.555 HG12 ' O ' ' A' ' 168' ' ' TRP . 30.6 mm -59.68 -24.28 28.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 177.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.411 ' CA ' HG13 ' A' ' 130' ' ' VAL . 2.7 tt0 -75.71 -44.64 40.98 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.779 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.76 -48.69 77.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.169 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -71.21 -32.06 68.36 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.067 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . . . . . . . . . 7.0 mt -66.04 -28.85 44.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.619 179.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.361 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.632 179.786 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo . . . . . 0 C--O 1.231 0.155 0 CA-C-O 120.879 0.283 . . . . 0.0 112.395 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.96 121.31 42.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.423 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.0 p -132.25 139.56 48.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.014 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.82 143.35 12.15 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.485 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.7 mt -69.52 106.98 3.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.764 0.316 . . . . 0.0 110.891 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.95 144.22 49.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.649 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -84.02 155.82 22.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.948 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tp -136.09 137.78 41.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.664 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.473 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.679 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.473 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 26.9 m95 . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.886 0.375 . . . . 0.0 111.139 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -108.6 146.86 32.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.806 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.7 ttt85 -72.9 136.07 45.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.008 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.4 ' HB ' ' O ' ' A' ' 42' ' ' SER . 35.1 m -141.17 169.95 14.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.109 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 tp -120.63 117.25 27.05 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.641 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -87.93 110.49 20.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.947 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.8 t -89.85 79.86 6.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.666 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tp -77.11 99.83 5.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.046 -179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.68 147.54 27.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.935 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -61.9 -16.22 48.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.444 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.49 -27.28 18.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.861 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -176.78 -179.74 1.0 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.974 0.416 . . . . 0.0 111.255 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -117.29 114.29 23.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.859 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.41 HG22 ' CD2' ' A' ' 122' ' ' HIS . 58.4 m -127.72 134.77 49.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.986 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.6 t -111.7 159.01 11.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.3 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.4 ' O ' ' HB ' ' A' ' 30' ' ' VAL . 9.9 p -148.04 160.64 37.05 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.372 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.11 47.43 2.23 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.496 2.131 . . . . 0.0 112.871 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.149 0 CA-C-O 121.018 0.437 . . . . 0.0 111.549 179.843 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.088 0 CA-C-O 120.717 0.294 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 17.1 mttm -101.8 90.66 4.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.928 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.41 ' CD2' HG22 ' A' ' 40' ' ' THR . 19.7 m80 -84.98 138.91 32.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 19.2 t -138.45 116.88 13.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.074 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 92.5 p -70.8 125.15 26.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.905 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.52 -179.48 0.84 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.917 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 60.48 35.77 20.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.859 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.5 mmt -164.74 -44.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.89 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.64 -165.54 0.06 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.256 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -169.86 127.07 0.87 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.503 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.465 ' CG2' ' N ' ' A' ' 131' ' ' SER . 2.5 p -99.84 158.88 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.361 0.6 . . . . 0.0 111.646 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -166.5 133.0 2.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.677 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 39.4 ptt85 -102.96 96.05 6.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.846 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.914 -179.952 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.452 ' CZ ' ' CD ' ' A' ' 158' ' ' ARG . 15.0 m-85 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.817 0.342 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 80.8 mt -83.58 132.63 34.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.777 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -133.68 125.36 28.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.789 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 22.8 mt -130.46 117.99 41.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.187 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 35.5 m -100.3 143.55 30.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.829 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -112.77 149.01 33.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.308 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.92 30.58 2.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.255 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -120.98 48.15 1.69 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.074 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.35 19.11 3.58 Favored Glycine 0 N--CA 1.451 -0.332 0 CA-C-N 115.615 -0.72 . . . . 0.0 112.173 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.406 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.8 mm-40 58.45 61.14 2.34 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 121.123 0.487 . . . . 0.0 111.063 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -87.6 161.97 17.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.835 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.61 93.7 0.84 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.1 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.0 m -85.71 124.57 40.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.029 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -105.98 106.06 16.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.765 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.8 mt -113.76 164.6 13.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.076 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.452 ' CD ' ' CZ ' ' A' ' 143' ' ' TYR . 1.3 tpt180 -130.96 97.29 4.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.694 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -55.52 174.15 0.11 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.413 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -88.85 -67.21 0.85 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.003 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.39 173.84 7.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.105 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.52 -34.01 25.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.923 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -74.2 -46.33 42.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.936 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' A' ' 168' ' ' TRP . 0.4 OUTLIER -62.5 -39.97 95.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.651 179.757 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.69 -42.34 86.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.997 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.7 mtt180 -70.7 -40.68 72.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.55 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 41.9 p -67.98 -33.05 73.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.145 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . 0.405 ' HB2' ' O ' ' A' ' 164' ' ' SER . 7.7 m95 -73.0 -50.86 20.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.875 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -56.45 -50.06 72.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.306 0.574 . . . . 0.0 110.467 179.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.26 -42.2 95.32 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.647 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.04 -40.53 78.54 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.964 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.468 HG22 ' CD1' ' A' ' 176' ' ' ILE . 31.8 mt -60.89 -24.51 32.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.462 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.1 OUTLIER -81.77 -28.78 33.09 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.219 179.161 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.76 -50.54 66.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.128 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -67.29 -41.54 85.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.856 178.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . 0.468 ' CD1' HG22 ' A' ' 172' ' ' ILE . 83.1 mt -77.39 -5.59 7.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.224 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.331 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.541 179.847 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo . . . . . 0 C--O 1.231 0.158 0 CA-C-O 120.775 0.24 . . . . 0.0 112.36 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.4 ttm105 -70.59 133.98 47.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.874 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 75.2 p -135.17 138.86 44.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.005 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.51 126.88 2.9 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.38 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 64.4 mt -68.85 99.38 1.03 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.823 0.344 . . . . 0.0 110.937 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.03 151.17 24.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.788 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -88.35 134.79 33.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.5 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 20.6 tp -108.39 139.17 43.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.495 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.516 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.226 0 CA-C-O 120.746 0.307 . . . . 0.0 110.918 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.516 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 33.5 m95 . . . . . 0 CA--C 1.528 0.106 0 CA-C-O 120.796 0.331 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -89.65 -176.69 5.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.686 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.41 130.08 54.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.851 0.358 . . . . 0.0 110.911 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 33.8 m -137.11 134.14 47.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.264 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 10.5 tp -78.86 128.12 32.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.7 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.38 123.6 43.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.045 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.1 t -97.51 89.87 4.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.708 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.415 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 2.5 tp -93.56 95.11 9.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.04 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.46 153.11 22.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.915 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -64.44 -14.04 54.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.409 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -96.13 -21.94 17.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.094 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -178.15 174.2 1.38 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.844 0.354 . . . . 0.0 111.134 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 21.6 tp -131.21 97.5 4.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.773 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.406 HG21 ' CD2' ' A' ' 122' ' ' HIS . 51.8 m -111.53 137.44 49.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.946 -179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.6 t -100.25 159.55 3.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.047 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -170.05 149.71 3.43 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.814 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.89 153.06 16.0 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.511 2.141 . . . . 0.0 112.13 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.122 -179.985 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.853 0.358 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 31.8 mttt -131.74 91.51 3.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.951 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.406 ' CD2' HG21 ' A' ' 40' ' ' THR . 36.6 m80 -70.1 134.49 48.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.763 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 22.0 t -133.65 116.86 25.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.079 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 5.1 m -62.46 164.5 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.984 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -124.48 33.55 5.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.911 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -145.33 35.93 1.09 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.891 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.5 tpt -178.67 -37.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.994 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.12 -169.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.306 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -167.87 122.85 1.0 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.537 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.502 HG13 ' N ' ' A' ' 173' ' ' GLN . 2.2 p -98.61 159.31 3.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.288 0.565 . . . . 0.0 111.525 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.473 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 12.5 m -162.94 157.7 21.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.743 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . 0.404 ' NH1' ' HB3' ' A' ' 132' ' ' ARG . 12.7 ttp-105 -140.09 117.95 11.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.956 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.831 179.843 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 2.0 t80 . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.858 0.361 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 7.1 mt -120.39 126.51 50.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.793 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -134.53 132.16 38.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.885 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.449 HG21 HD11 ' A' ' 146' ' ' ILE . 18.5 mt -129.49 125.8 62.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.128 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 30.4 p -104.74 130.96 52.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -110.18 147.31 33.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.167 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.97 30.57 2.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.306 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -115.74 45.29 1.73 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.191 0.519 . . . . 0.0 110.139 179.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 118.68 22.16 3.73 Favored Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.191 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.4 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.0 mm-40 58.74 61.65 2.13 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 121.14 0.495 . . . . 0.0 110.826 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -88.12 158.96 18.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.802 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -157.21 85.44 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.191 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 4.7 m -80.0 123.82 37.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.192 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -105.91 106.54 17.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.644 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.1 mt -119.85 160.85 21.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.151 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.402 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 22.5 ttt180 -132.46 107.74 8.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.764 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.68 173.05 0.44 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.228 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.02 -29.4 14.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.888 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -123.66 143.99 49.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.906 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -45.96 82.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.962 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.71 -39.94 88.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.007 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 68.4 m -61.91 -48.92 78.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.686 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -59.52 -39.75 84.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.031 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 5.0 mtt85 -69.9 -46.71 64.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.41 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.5 t -64.51 -33.23 75.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.219 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . 0.415 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -72.93 -51.25 19.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.845 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -55.72 -56.26 22.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.309 0.576 . . . . 0.0 110.516 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.41 -36.85 78.79 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.752 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -71.84 -39.86 69.46 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.157 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.432 HG21 ' HB ' ' A' ' 130' ' ' VAL . 7.4 mt -63.58 -22.2 30.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.606 -0.886 . . . . 0.0 108.606 177.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.502 ' N ' HG13 ' A' ' 130' ' ' VAL . 1.2 tp60 -77.76 -40.88 39.45 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.483 179.546 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.49 -33.05 75.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.766 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -29.39 30.29 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.09 179.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . . . . . . . . . 17.2 mt -71.59 -27.75 29.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.691 179.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 0.288 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.612 179.739 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo . . . . . 0 C--O 1.231 0.146 0 CA-C-O 120.779 0.241 . . . . 0.0 112.356 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.403 ' CZ ' ' HB3' ' A' ' 8' ' ' ARG . 4.3 ptp180 -112.93 135.69 53.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.868 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.4 p -124.61 168.44 13.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.966 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.55 126.71 1.25 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.47 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.5 mt -59.68 128.05 35.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.843 0.354 . . . . 0.0 110.932 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.48 140.68 27.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.806 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.95 154.93 37.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.939 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 16.1 tp -134.73 130.96 37.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.452 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.506 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 2.6 ttp180 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.801 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.506 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 43.0 m95 . . . . . 0 CA--C 1.529 0.147 0 CA-C-O 120.738 0.304 . . . . 0.0 111.02 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -153.17 158.08 41.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.095 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -82.34 123.56 29.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.946 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 20.5 m -143.31 123.22 9.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.209 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.85 134.85 48.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.613 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.84 121.85 41.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.979 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.2 t -100.37 86.0 3.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.694 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 tp -80.27 129.65 34.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.028 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -135.26 138.67 43.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.06 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.72 -23.69 44.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.037 0.446 . . . . 0.0 111.285 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -88.83 -30.15 19.16 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.929 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -175.41 173.01 2.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.032 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -114.71 129.01 56.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.942 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 28.6 m -128.33 129.65 46.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.752 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 13.9 t -107.28 159.02 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.317 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.3 t -159.59 149.0 14.46 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.451 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -75.07 43.03 0.92 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.654 2.236 . . . . 0.0 113.23 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.237 0 CA-C-O 120.939 0.399 . . . . 0.0 111.846 179.594 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.748 0.308 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 94.11 6.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.803 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -86.33 104.54 15.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.996 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.2 t -108.19 139.89 28.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.039 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.9 152.21 19.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.961 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.8 tp -131.95 31.47 4.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.903 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.95 41.74 2.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.724 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 174.88 -32.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.914 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.4 ' CB ' ' HA ' ' A' ' 148' ' ' ALA . . . -54.32 -171.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.378 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -161.23 107.1 1.38 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.587 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.472 HG13 ' N ' ' A' ' 173' ' ' GLN . 1.6 p -80.23 158.64 4.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.233 0.539 . . . . 0.0 111.359 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.472 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.4 OUTLIER -160.48 150.04 17.53 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.646 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.5 ptt85 -124.0 111.48 16.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.086 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.816 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 1.9 t80 . . . . . 0 CA--C 1.527 0.059 0 CA-C-O 120.74 0.305 . . . . 0.0 110.829 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 91.4 mt -96.2 139.88 31.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.918 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -148.1 130.02 15.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.729 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 14.8 mt -130.89 123.26 53.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.295 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 60.1 m -108.42 119.38 39.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.667 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . 0.4 ' HA ' ' CB ' ' A' ' 128' ' ' ALA . . . -100.11 143.14 30.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.377 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.58 30.89 2.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.167 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -121.35 47.8 1.78 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.381 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 125.69 18.7 2.39 Favored Glycine 0 CA--C 1.519 0.292 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.524 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.95 60.93 2.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.973 0.416 . . . . 0.0 110.925 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -93.44 152.94 18.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.713 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -160.49 86.88 0.74 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.085 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.5 m -84.12 124.83 40.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.111 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -109.47 102.47 11.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.904 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.0 mt -113.67 167.99 10.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.136 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.429 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 5.5 ttt-85 -144.4 97.6 3.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.702 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -55.69 171.28 0.22 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.423 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.42 -30.54 13.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.029 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -105.97 164.83 11.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.893 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -79.98 -65.31 1.02 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.958 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -60.04 -26.79 66.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.151 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 4.5 t -68.96 -43.49 74.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.908 0.385 . . . . 0.0 110.282 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -73.31 -28.23 61.97 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.544 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 11.1 ptt85 -79.28 -40.48 30.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.429 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.3 t -70.95 -31.76 68.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.108 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 9.9 m95 -71.51 -47.4 55.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.854 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . 0.412 ' O ' HG13 ' A' ' 130' ' ' VAL . . . -58.17 -48.95 78.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.263 0.554 . . . . 0.0 110.465 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.45 -42.48 95.85 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.581 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.89 -40.76 75.47 Favored 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 120.854 -0.338 . . . . 0.0 110.746 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . . . . . . . . . 11.8 mt -61.11 -23.12 28.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 177.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.472 ' N ' HG13 ' A' ' 130' ' ' VAL . 1.2 tt0 -77.74 -42.1 35.41 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.618 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.82 -43.68 92.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.487 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 74.6 mm-40 -67.28 -37.23 83.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.074 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.8 -33.27 51.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.694 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.593 179.973 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.79 0.246 . . . . 0.0 112.309 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -110.61 144.85 38.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.739 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.2 p -133.32 164.03 28.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -158.08 118.64 0.84 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.338 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 17.8 mt -59.44 93.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.843 0.354 . . . . 0.0 110.913 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -96.32 170.04 9.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.787 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -110.94 146.93 35.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.964 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 14.6 tp -125.37 142.99 51.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.738 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.479 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.697 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.479 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 12.1 m95 . . . . . 0 C--O 1.233 0.197 0 CA-C-O 120.77 0.319 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -65.95 178.97 0.97 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.136 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 tmm_? -117.92 110.82 18.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.824 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 29.0 m -113.96 138.44 43.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.157 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.0 tp -83.69 127.42 33.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.561 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 mp -98.16 101.28 12.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.119 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.45 94.03 9.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.648 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 tp -87.69 129.81 35.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.992 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -135.72 140.07 44.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.972 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.7 -23.09 49.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.072 0.463 . . . . 0.0 111.251 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -86.47 -30.85 21.71 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.93 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -178.16 -178.66 0.67 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.99 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.37 157.6 21.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.922 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.413 HG21 ' CD2' ' A' ' 122' ' ' HIS . 24.7 m -158.24 128.02 5.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.626 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 10.7 t -119.78 157.97 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.012 0.434 . . . . 0.0 111.348 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.5 t -160.1 157.57 25.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.406 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo -73.85 39.56 0.52 Allowed 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.732 2.288 . . . . 0.0 112.973 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.177 0 CA-C-O 121.018 0.437 . . . . 0.0 111.404 -179.999 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.786 0.327 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 18.1 mttm -121.07 108.86 14.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.897 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.413 ' CD2' HG21 ' A' ' 40' ' ' THR . 14.1 m80 -109.92 144.63 38.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.949 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 4.0 t -123.39 127.32 74.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.869 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 56.4 p -58.27 -30.19 66.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.231 -179.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.1 mp 65.05 31.01 11.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.928 0.394 . . . . 0.0 110.832 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.18 36.12 3.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.716 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.5 mtp 170.01 -28.85 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.896 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -51.32 -177.86 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.976 0.417 . . . . 0.0 111.574 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -165.08 115.97 1.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.514 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.474 HG13 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -89.66 158.61 2.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.287 0.565 . . . . 0.0 111.487 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -167.92 128.08 1.34 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.707 -179.947 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.27 112.21 24.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.083 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.762 179.925 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 . . . . . 0 CA--C 1.527 0.077 0 CA-C-O 120.785 0.326 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.1 mt -83.32 88.93 6.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.878 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -96.51 137.81 35.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.965 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 25.2 mt -141.46 126.76 18.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.035 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 63.8 m -114.22 130.6 56.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.049 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -112.15 152.03 28.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.103 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.87 30.96 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.356 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -111.03 42.41 1.64 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.336 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.22 26.79 1.96 Allowed Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.354 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 57.59 59.24 3.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.106 0.479 . . . . 0.0 111.006 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -90.13 152.3 21.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.774 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.13 94.23 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.056 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 10.8 m -95.76 132.98 38.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.169 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.449 ' CD1' ' N ' ' A' ' 156' ' ' PHE . 0.7 OUTLIER -119.06 98.77 6.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.897 179.918 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.02 167.92 9.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.937 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' ARG . . . . . 0.427 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.9 OUTLIER -129.46 107.34 9.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.776 179.976 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.39 173.45 0.51 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.15 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.23 -30.14 16.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.039 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -122.53 157.78 31.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.929 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.09 -42.62 69.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.062 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.7 76.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.98 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 60.4 p -63.9 -44.26 93.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.653 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -62.84 -43.86 97.68 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.923 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.67 -42.4 77.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.484 179.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 91.1 p -66.57 -34.67 78.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.2 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 12.1 m95 -73.0 -50.13 24.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.785 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . 0.404 ' O ' HG13 ' A' ' 130' ' ' VAL . . . -56.31 -51.13 69.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.271 0.557 . . . . 0.0 110.592 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.73 -41.31 95.79 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.71 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.41 -41.33 80.6 Favored 'General case' 0 CA--C 1.511 -0.544 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.141 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.433 HG23 ' HB ' ' A' ' 130' ' ' VAL . 7.0 mt -62.41 -23.38 32.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 173' ' ' GLN . . . . . 0.474 ' N ' HG13 ' A' ' 130' ' ' VAL . 0.4 OUTLIER -79.97 -30.73 39.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.353 179.286 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -66.36 -47.03 74.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.423 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -71.05 -37.02 72.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.234 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 176' ' ' ILE . . . . . 0.401 HD12 ' CG2' ' A' ' 172' ' ' ILE . 70.3 mt -83.33 -5.95 9.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.373 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.321 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.321 179.828 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.798 0.332 . . . . 0.0 110.988 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.5 m -153.58 78.53 1.14 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.857 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.29 148.07 3.61 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.476 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.48 -40.95 3.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.867 0.365 . . . . 0.0 110.924 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.0 tpp85 -65.46 90.72 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.828 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.16 136.3 23.7 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.101 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.17 158.73 51.45 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.496 2.13 . . . . 0.0 112.281 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.5 ttm-85 -82.56 130.25 35.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.559 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 21.7 p -120.65 146.37 46.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.971 0.415 . . . . 0.0 111.224 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -134.73 127.69 4.54 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.465 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.1 mt -69.82 101.24 1.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.944 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.23 164.2 17.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.717 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -89.55 163.79 15.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.959 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 18.1 tp -137.53 124.67 21.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.665 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.477 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 33.8 ttt180 -69.52 169.16 13.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.657 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 13.9 t -169.63 41.66 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.827 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -125.35 30.42 4.52 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.515 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.33 121.43 12.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.765 0.317 . . . . 0.0 111.123 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -167.41 -67.53 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.53 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.3 t -169.93 -68.46 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.758 0.313 . . . . 0.0 110.835 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.03 -145.54 2.04 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.532 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -151.25 30.58 0.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.807 0.337 . . . . 0.0 111.127 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -112.75 27.63 9.61 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.453 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -158.36 49.24 0.42 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.51 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -78.69 136.97 37.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.796 0.331 . . . . 0.0 110.959 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.8 50.39 1.35 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.814 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.477 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.4 m95 -48.98 168.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.167 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -166.63 141.61 4.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -64.2 136.04 56.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.007 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 31.6 m -146.36 169.98 5.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.12 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -107.17 141.62 38.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.725 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.9 mp -114.54 82.84 1.79 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.901 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.95 88.9 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.58 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 tp -87.73 119.18 27.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.236 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -109.79 156.07 20.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.815 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -49.9 -22.82 1.64 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.793 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -152.87 38.14 0.51 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.204 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -175.2 119.92 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.957 0.408 . . . . 0.0 111.646 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -104.16 100.88 10.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.496 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.415 HG23 ' CD2' ' A' ' 122' ' ' HIS . 85.5 m -109.78 126.75 54.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.369 -179.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.5 t -94.56 158.57 2.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.391 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -149.52 166.4 15.33 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.904 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -82.6 50.72 3.49 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.658 2.238 . . . . 0.0 112.46 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 49.23 30.33 3.05 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.188 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -141.79 179.6 6.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.021 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -109.89 176.34 19.2 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.473 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -94.73 131.04 31.45 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.506 0.193 . . . . 0.0 110.942 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.7 124.25 8.64 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.457 2.104 . . . . 0.0 112.349 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.21 -149.21 6.4 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.483 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.05 -8.03 22.7 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.639 2.226 . . . . 0.0 112.62 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -100.58 95.79 4.71 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-O 120.669 0.271 . . . . 0.0 110.871 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -68.76 164.31 33.84 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.493 2.129 . . . . 0.0 112.276 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.42 137.98 18.35 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.89 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -74.28 163.17 37.03 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.454 2.103 . . . . 0.0 112.298 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.65 176.18 0.4 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.049 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -116.4 128.14 55.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.876 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.8 mt -87.51 138.22 31.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.907 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -108.81 -63.11 1.38 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.902 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 117.17 -86.31 0.41 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.415 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -139.73 120.88 14.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.33 . . . . 0.0 111.044 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -154.21 102.62 2.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.15 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -94.46 152.05 39.77 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.851 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.19 135.46 52.78 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.487 2.125 . . . . 0.0 112.33 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 160.64 65.51 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.451 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -137.85 98.02 3.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.846 0.355 . . . . 0.0 111.153 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.455 ' N ' ' CD ' ' A' ' 67' ' ' PRO . . . -87.02 -51.15 0.44 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.709 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.49 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 52.9 Cg_exo -52.13 -46.99 29.02 Favored 'Trans proline' 0 CA--C 1.529 0.238 0 C-N-CA 122.895 2.397 . . . . 0.0 112.958 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.49 ' HD3' ' HB2' ' A' ' 67' ' ' PRO . 90.3 Cg_endo -82.17 134.84 8.22 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.82 2.346 . . . . 0.0 112.308 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -138.79 117.68 12.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.967 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.1 mt -125.92 103.91 26.98 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.854 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.53 -166.32 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.452 2.102 . . . . 0.0 112.308 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 67.21 72.58 0.35 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.334 0.587 . . . . 0.0 110.618 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 168.89 -43.34 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.562 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.1 mp -89.52 -33.28 16.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.744 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.7 mp -65.87 -33.15 75.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.819 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.6 -46.02 15.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.772 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -95.16 55.25 1.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.949 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 3.7 ttp180 -92.25 -39.53 11.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.945 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -96.99 39.95 1.16 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.905 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.2 t -133.94 -44.76 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.155 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.461 ' N ' ' HD2' ' A' ' 82' ' ' PRO . 0.5 OUTLIER -56.54 -55.75 39.5 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.274 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 81' ' ' SER . 67.3 Cg_endo -76.07 58.88 5.71 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.893 2.395 . . . . 0.0 112.459 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 55.07 -168.92 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.153 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -164.34 166.59 20.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 71.12 -63.72 0.41 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.944 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -95.91 35.18 1.43 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.959 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -109.98 -31.26 7.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.837 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.13 151.45 47.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.103 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 132.45 99.34 0.73 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.556 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -91.89 68.14 2.04 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.572 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.1 t -136.59 -47.37 0.62 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.742 0.306 . . . . 0.0 110.867 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.2 t -147.93 173.48 12.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.933 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 14.9 p 42.1 44.0 0.33 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.83 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.59 53.64 4.57 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.57 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 30.3 m0 -97.19 61.12 1.71 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.943 0.402 . . . . 0.0 110.757 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -100.26 35.29 2.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.848 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 52.7 p -124.72 75.26 64.53 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.97 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.92 108.19 0.37 Allowed 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.556 2.171 . . . . 0.0 112.319 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.99 -26.64 83.52 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.433 2.088 . . . . 0.0 112.012 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -120.58 -176.09 3.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.002 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.5 t -166.95 61.38 0.61 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.063 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.75 60.37 5.21 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.587 2.191 . . . . 0.0 112.351 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -123.22 97.7 5.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.927 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -161.52 116.67 2.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.852 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.37 160.1 43.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.945 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.406 ' N ' ' HD3' ' A' ' 107' ' ' PRO . 2.2 tt0 59.22 63.12 3.74 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.056 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.406 ' HD3' ' N ' ' A' ' 106' ' ' GLN . 31.3 Cg_exo -58.8 -41.39 63.39 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.507 2.138 . . . . 0.0 112.078 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -158.72 124.92 4.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.771 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.435 ' CB ' ' CD ' ' A' ' 110' ' ' PRO . 0.5 OUTLIER -179.5 -61.53 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.995 -179.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.435 ' CD ' ' CB ' ' A' ' 109' ' ' SER . 56.2 Cg_endo -71.65 -167.17 0.28 Allowed 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.865 2.377 . . . . 0.0 112.326 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -131.09 65.87 0.59 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.65 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -57.71 -160.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.568 2.179 . . . . 0.0 112.16 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -127.57 78.04 75.27 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -52.36 92.56 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.606 2.204 . . . . 0.0 112.273 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.97 116.59 33.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.831 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -166.07 -56.58 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.862 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.47 -31.44 9.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.779 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.9 t 62.61 -80.99 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.028 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.51 141.15 33.77 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.913 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.99 179.61 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.084 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.59 82.8 2.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.928 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.415 ' CD2' HG23 ' A' ' 40' ' ' THR . 14.5 m-70 -76.18 135.62 39.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.829 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.5 t -138.62 120.77 17.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.116 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 5.6 m -59.69 151.38 25.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.858 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 59.7 mt -109.32 38.08 2.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.899 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.93 34.23 4.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.833 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 10.5 ptt? 179.3 -36.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.044 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.85 -176.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.379 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.465 ' CD1' ' N ' ' A' ' 129' ' ' TYR . 0.0 OUTLIER -167.44 125.79 1.28 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.472 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.468 ' CG2' ' N ' ' A' ' 131' ' ' SER . 2.2 p -94.19 159.18 2.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 121.255 0.55 . . . . 0.0 111.406 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.468 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 34.4 p -157.85 134.89 10.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.86 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 9.8 ttm105 -96.15 95.64 8.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.874 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -83.28 -177.06 6.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.95 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -139.85 155.12 47.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.953 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -99.09 152.3 37.73 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.904 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.97 -28.56 60.04 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.538 2.159 . . . . 0.0 112.484 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.4 p -95.19 -45.74 7.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.106 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.0 t0 59.99 73.82 0.62 Allowed Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.806 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.31 -45.11 5.77 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.587 2.192 . . . . 0.0 112.307 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.428 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.5 OUTLIER -174.88 -63.06 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.869 179.786 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.428 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 60.9 Cg_endo -72.68 119.25 5.98 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.522 2.148 . . . . 0.0 112.276 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 3.5 mmt180 -61.11 161.91 8.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.887 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -86.42 142.09 28.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.9 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.0 140.55 51.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.794 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.43 ' CG ' ' CE2' ' A' ' 156' ' ' PHE . 6.0 tm-20 -148.68 126.49 11.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.826 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 29.6 mt -126.41 118.51 51.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.161 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 7.8 m -99.56 138.15 37.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.814 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -114.24 149.07 36.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.219 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.14 30.4 2.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.286 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -115.23 45.03 1.71 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.186 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.3 22.73 3.37 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.132 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.401 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.6 mm-40 58.1 61.06 2.45 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.17 0.51 . . . . 0.0 110.968 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -87.43 157.67 19.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.911 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -156.47 90.93 1.2 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.119 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 7.3 m -84.61 118.66 32.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.233 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.43 ' CE2' ' CG ' ' A' ' 145' ' ' GLU . 70.2 m-85 -106.18 116.19 31.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.749 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -127.18 160.58 30.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.03 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.44 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 5.2 tmm_? -135.78 94.11 3.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.811 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -54.92 172.35 0.11 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.366 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.07 -32.66 11.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.885 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -98.32 162.39 13.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.931 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.46 -51.64 6.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.955 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -69.07 -30.62 68.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 20.2 m -67.66 -52.84 33.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.652 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.34 -35.83 78.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.976 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -43.62 54.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.491 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 5.1 m -67.75 -30.15 69.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.046 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 5.4 m95 -71.28 -50.95 27.35 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.972 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . 0.428 ' O ' HG13 ' A' ' 130' ' ' VAL . . . -56.09 -51.52 67.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.325 0.583 . . . . 0.0 110.575 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -56.81 -41.03 90.63 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.58 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.21 -40.58 77.91 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.842 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.449 HG23 ' CD1' ' A' ' 176' ' ' ILE . 18.3 mt -60.07 -24.68 30.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.445 ' N ' HG13 ' A' ' 130' ' ' VAL . 4.2 tt0 -82.52 -28.35 31.14 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.255 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.11 -49.67 69.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.116 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -68.74 -41.07 79.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.75 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . 0.449 ' CD1' HG23 ' A' ' 172' ' ' ILE . 91.7 mt -76.79 -7.55 10.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.282 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -86.13 25.52 6.88 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.481 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.5 t . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.866 179.998 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.809 0.338 . . . . 0.0 111.014 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -172.23 151.69 2.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.756 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 72.42 80.46 0.4 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.6 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.74 -174.59 2.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.714 0.293 . . . . 0.0 110.902 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.78 155.55 49.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.934 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.32 108.59 40.03 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.008 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.04 158.52 57.56 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.382 2.055 . . . . 0.0 112.284 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -79.39 141.04 37.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.775 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.8 p -139.17 138.8 37.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.058 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -146.18 127.25 2.72 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.418 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.2 mt -59.03 103.99 0.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.775 0.322 . . . . 0.0 110.985 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.2 170.13 8.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.723 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -114.66 151.64 33.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.003 0.43 . . . . 0.0 111.123 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.408 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 1.2 tp -137.48 142.38 41.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.407 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.57 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.54 -178.07 1.35 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.887 0.375 . . . . 0.0 110.891 -179.547 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.9 t -174.16 103.77 0.11 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.985 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -106.12 -71.37 0.79 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.544 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 61.77 154.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.845 0.355 . . . . 0.0 111.118 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.5 -136.18 13.28 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.506 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.75 -67.54 0.85 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 0.0 110.854 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 173.55 39.48 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.459 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.35 163.87 21.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.812 0.339 . . . . 0.0 111.2 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -73.57 65.87 1.7 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.476 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -127.34 36.0 2.68 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.493 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -60.23 95.63 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.844 0.354 . . . . 0.0 110.782 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -92.14 77.66 5.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.898 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.57 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 12.8 m95 -59.42 95.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.829 179.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.85 179.11 6.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.907 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.4 ttp180 -112.32 133.41 54.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.895 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.408 ' CG2' ' CD2' ' A' ' 157' ' ' LEU . 27.7 m -139.54 120.91 15.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.206 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.9 tp -71.53 128.99 37.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.596 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.27 132.16 40.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.026 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -108.97 84.97 2.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.778 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.3 tp -82.0 108.88 15.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.997 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.58 146.39 44.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.022 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -61.5 -16.24 45.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.485 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -95.3 -25.51 16.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.994 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -179.07 178.52 0.73 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.917 0.389 . . . . 0.0 111.089 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.07 113.12 18.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.801 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.421 HG23 ' CD2' ' A' ' 122' ' ' HIS . 56.5 m -116.8 134.16 55.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.942 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.1 t -115.8 159.77 15.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.17 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.2 t -155.56 157.8 31.67 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.553 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -75.24 44.43 1.2 Allowed 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.943 2.429 . . . . 0.0 112.725 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 45.28 30.04 0.62 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.917 0.389 . . . . 0.0 111.348 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -71.85 127.22 31.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.998 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -73.88 -159.25 5.94 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.499 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.09 122.47 81.34 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 120.506 0.193 . . . . 0.0 110.854 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.29 115.68 2.54 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.421 2.081 . . . . 0.0 112.375 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.422 ' N ' ' HD3' ' A' ' 50' ' ' PRO . . . -177.6 62.08 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.524 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.422 ' HD3' ' N ' ' A' ' 49' ' ' GLY . 24.3 Cg_exo -63.22 148.71 92.83 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.696 2.264 . . . . 0.0 112.261 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.408 ' CB ' ' CD ' ' A' ' 52' ' ' PRO . 9.8 mm-40 -83.54 -62.33 0.28 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.0 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.408 ' CD ' ' CB ' ' A' ' 51' ' ' GLU . 72.9 Cg_endo -76.46 160.75 35.12 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.461 2.107 . . . . 0.0 112.361 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -153.02 89.82 3.64 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.907 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.35 -172.91 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.566 2.177 . . . . 0.0 112.309 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -140.23 99.29 3.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.089 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 59.5 105.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.921 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -134.65 152.39 51.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.828 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -97.5 -45.77 6.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 138.03 153.43 6.27 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.414 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -79.96 152.55 29.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.775 0.321 . . . . 0.0 111.149 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -97.63 129.76 44.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.181 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -71.41 146.82 92.26 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.898 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.88 146.59 35.75 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.474 2.116 . . . . 0.0 112.343 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -113.76 -30.19 2.65 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.528 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -138.88 94.01 2.77 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.766 0.317 . . . . 0.0 111.037 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -151.77 156.88 34.59 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.023 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.5 140.23 39.41 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.541 2.161 . . . . 0.0 112.246 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.39 76.27 3.6 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.451 2.101 . . . . 0.0 112.322 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -95.76 162.39 13.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.0 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.0 111.35 26.26 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.804 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.71 -168.6 0.19 Allowed 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.373 2.049 . . . . 0.0 112.445 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 66.09 72.07 0.4 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.506 0.67 . . . . 0.0 110.762 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 170.64 -47.19 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.784 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 8.2 mp -92.61 -31.4 15.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.9 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 pp -73.76 -27.19 61.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.119 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -56.93 -30.78 64.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.911 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.38 -27.72 63.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.81 -30.13 63.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.96 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -98.2 31.88 2.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.886 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.6 t -136.67 -64.66 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.044 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 61.91 151.74 0.1 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.926 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.49 58.36 5.17 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.605 2.204 . . . . 0.0 112.42 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -178.57 38.1 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.913 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -78.48 112.76 15.87 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.954 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -158.64 93.83 1.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.882 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -98.1 -32.44 11.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.853 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.02 150.29 36.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.853 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 63.81 130.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.081 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 65.26 170.64 2.79 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.497 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 132.81 149.3 6.16 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.477 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.7 t -95.67 157.29 15.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.867 0.365 . . . . 0.0 110.85 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 60.51 21.56 11.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.135 0.493 . . . . 0.0 111.214 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 14.2 p -84.61 116.1 27.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.185 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 166.88 -86.12 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.484 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 60.46 97.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.836 0.351 . . . . 0.0 110.815 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -139.49 36.26 2.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.905 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.2 t -165.86 87.8 0.92 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.914 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -68.81 111.1 2.52 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.566 2.177 . . . . 0.0 112.289 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -79.64 -27.33 4.14 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.582 2.188 . . . . 0.0 112.226 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -147.53 124.54 11.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.106 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.4 p -73.79 158.14 86.46 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.876 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.55 106.54 0.15 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.599 2.199 . . . . 0.0 112.212 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 37.9 mt -99.02 -34.73 10.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -148.6 -178.63 6.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.929 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -120.0 -42.71 2.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.925 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -176.46 83.14 0.27 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.48 85.2 0.58 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.524 2.149 . . . . 0.0 112.357 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.5 m 62.2 118.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.959 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.43 ' CB ' ' CD ' ' A' ' 110' ' ' PRO . 0.4 OUTLIER 179.48 -60.75 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.904 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.43 ' CD ' ' CB ' ' A' ' 109' ' ' SER . 69.7 Cg_endo -75.15 142.9 27.96 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.909 2.406 . . . . 0.0 112.3 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -146.92 149.34 21.47 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.495 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.4 91.18 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.615 2.21 . . . . 0.0 112.223 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.454 ' N ' ' HD2' ' A' ' 114' ' ' PRO . 17.2 mm-40 -69.3 -55.81 9.36 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.105 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 113' ' ' GLN . 73.6 Cg_endo -77.17 176.15 10.47 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.964 2.443 . . . . 0.0 112.33 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -140.7 31.81 1.84 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.924 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -75.17 -66.56 0.75 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.875 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 4.2 pp -160.78 139.75 10.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.907 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -132.27 159.13 39.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.899 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 59.78 22.12 10.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.12 0.486 . . . . 0.0 111.14 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . 61.44 172.39 0.11 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.071 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.56 88.64 2.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.922 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.421 ' CD2' HG23 ' A' ' 40' ' ' THR . 14.8 m-70 -85.8 139.53 31.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.062 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 11.2 t -122.87 120.87 61.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.882 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.99 -28.31 16.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.317 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.2 tp 62.69 -174.38 0.15 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.754 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt 57.54 37.2 27.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.835 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.99 -36.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.925 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.402 ' HB1' ' CG1' ' A' ' 176' ' ' ILE . . . -56.08 -169.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.071 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -161.89 116.56 1.93 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.956 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.469 ' CG2' ' N ' ' A' ' 131' ' ' SER . 1.4 p -97.08 158.69 3.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.184 0.516 . . . . 0.0 111.154 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.2 m -163.88 156.41 17.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.84 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 19.7 ttp-105 -122.54 93.67 4.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.978 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -123.93 169.57 11.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.72 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 6.6 p -110.89 -177.91 3.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.955 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.408 HG22 ' HD2' ' A' ' 136' ' ' PRO . 0.5 OUTLIER -167.22 -63.19 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.939 179.847 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . 0.408 ' HD2' HG22 ' A' ' 135' ' ' THR . 33.3 Cg_endo -67.46 -68.3 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.114 1.876 . . . . 0.0 112.45 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 3.4 t 178.17 42.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.856 0.36 . . . . 0.0 110.704 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -55.04 107.5 0.89 Allowed Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.954 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -63.49 -66.86 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.5 2.133 . . . . 0.0 112.462 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.462 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 3.9 mm-40 -96.36 -66.06 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.532 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.462 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 58.9 Cg_endo -72.19 -167.41 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.241 1.96 . . . . 0.0 112.417 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.6 mtt85 -152.58 175.11 13.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.82 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.406 ' CE1' ' HD2' ' A' ' 158' ' ' ARG . 3.4 m-30 -82.97 119.77 24.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.937 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.33 98.75 11.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.655 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 8.3 tm-20 -102.74 132.09 49.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.976 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 5.1 mp -135.74 111.58 12.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.906 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.5 m -100.6 134.09 44.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.873 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -108.11 145.31 34.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.283 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.56 31.55 2.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.104 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -125.35 50.1 1.83 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.283 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 126.13 14.61 2.98 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.663 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 61.06 62.93 1.33 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.063 0.459 . . . . 0.0 110.896 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -92.15 151.84 20.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.758 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -157.8 91.81 1.16 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.069 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 14.0 m -94.36 115.73 33.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.301 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -105.21 89.59 3.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.554 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.408 ' CD2' ' CG2' ' A' ' 30' ' ' VAL . 1.1 mt -104.88 167.96 9.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.302 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.447 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 14.7 ttt-85 -127.43 103.16 7.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.616 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -55.01 173.57 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.294 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -77.49 -69.54 0.53 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.068 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -110.25 177.6 4.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.04 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.85 -42.65 66.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.011 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -63.75 -50.86 67.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.982 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -46.58 88.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.591 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.29 -37.4 83.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.962 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.4 -47.9 58.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.443 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 56.3 m -64.7 -33.1 75.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.067 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 11.7 m95 -73.61 -50.8 19.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.712 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -57.15 -46.48 82.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.286 0.565 . . . . 0.0 110.474 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -60.49 -43.09 99.18 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.768 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.82 -40.37 72.48 Favored 'General case' 0 CA--C 1.509 -0.615 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.805 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . . . . . . . . . 11.8 mt -60.95 -23.73 30.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.448 ' N ' HG11 ' A' ' 130' ' ' VAL . 17.7 tt0 -78.87 -40.69 31.78 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.481 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.5 -46.18 84.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.43 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.07 -39.01 89.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.023 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . 0.402 ' CG1' ' HB1' ' A' ' 128' ' ' ALA . 1.2 mp -60.07 -36.05 65.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.592 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 129.9 56.05 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.46 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 4.4 t . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.035 179.935 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.808 0.337 . . . . 0.0 111.075 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.23 178.84 5.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.844 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 127.51 57.48 0.13 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.495 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -156.74 -61.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.829 0.347 . . . . 0.0 110.913 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -151.85 127.16 9.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.926 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -148.25 136.26 11.13 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.085 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.19 159.36 49.97 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.508 2.139 . . . . 0.0 112.386 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -85.41 140.91 30.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.634 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 70.4 p -137.24 147.28 45.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.849 0.357 . . . . 0.0 111.191 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -152.55 123.16 1.41 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.356 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 35.0 mt -56.39 102.87 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.829 0.347 . . . . 0.0 111.03 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.63 151.65 29.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.716 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -95.23 146.58 24.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.873 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 14.8 tp -125.03 142.94 51.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.45 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.483 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 19.1 ttp180 -69.41 160.66 30.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.576 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.403 ' HB3' ' CB ' ' A' ' 26' ' ' ARG . 33.7 t -143.4 38.82 1.4 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.917 0.389 . . . . 0.0 110.984 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -157.51 27.47 0.48 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.492 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -110.33 57.01 0.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.061 0.457 . . . . 0.0 111.114 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -122.8 -61.15 0.2 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.497 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m -153.85 134.21 13.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.786 0.327 . . . . 0.0 110.955 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 90.62 -145.23 17.83 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.513 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -173.58 147.33 1.41 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.836 0.35 . . . . 0.0 111.048 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.76 41.34 3.14 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.49 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.01 51.72 0.54 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.46 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -70.36 121.11 17.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.859 0.362 . . . . 0.0 111.015 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.403 ' CB ' ' HB3' ' A' ' 16' ' ' CYS . 40.9 mtp180 -141.46 47.42 1.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.803 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.483 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.8 m95 -49.14 115.03 1.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.148 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -97.97 178.65 5.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.983 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -105.94 129.95 53.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.845 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 32.6 m -144.46 123.51 6.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.358 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.5 tp -69.72 120.96 16.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.503 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -88.12 109.2 19.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.962 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 44.1 t -85.01 84.43 7.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.688 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.434 HD11 HG12 ' A' ' 172' ' ' ILE . 4.1 tp -78.74 125.9 30.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.306 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -129.95 141.65 50.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.928 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -63.03 -14.8 52.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.52 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -101.8 -19.89 15.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.108 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -173.5 172.08 3.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.878 0.37 . . . . 0.0 111.068 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.66 107.86 12.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.809 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -113.69 141.4 47.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.155 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 t -118.41 152.92 20.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.012 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.4 t -149.05 149.93 31.02 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.541 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.69 47.5 1.19 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.582 2.188 . . . . 0.0 112.838 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 45.19 30.09 0.6 Allowed 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.9 0.381 . . . . 0.0 111.408 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -121.4 108.08 13.25 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.025 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -91.6 143.23 16.46 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.486 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 43.19 84.37 0.19 Allowed Pre-proline 0 N--CA 1.464 0.243 0 CA-C-O 120.705 0.288 . . . . 0.0 111.403 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.9 125.26 13.9 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.51 2.14 . . . . 0.0 112.334 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -141.25 100.34 0.26 Allowed Glycine 0 CA--C 1.52 0.346 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.406 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -50.06 161.04 1.12 Allowed 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.612 2.208 . . . . 0.0 112.396 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -154.68 139.51 11.83 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.847 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.38 88.71 0.98 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.578 2.185 . . . . 0.0 112.278 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -60.7 160.51 19.07 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.933 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.59 125.83 18.31 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.613 2.209 . . . . 0.0 112.223 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.83 129.6 42.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.246 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 58.92 29.75 19.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.936 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.4 ' N ' ' CD1' ' A' ' 57' ' ' LEU . 6.7 mp 58.62 166.45 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.931 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -100.31 99.3 9.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.971 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 115.1 166.97 15.24 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.431 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.83 -171.56 0.1 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.789 0.328 . . . . 0.0 111.129 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -137.37 152.06 49.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.207 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.419 ' N ' ' HD3' ' A' ' 63' ' ' PRO . 10.8 pt-20 43.59 64.28 6.96 Favored Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.508 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.419 ' HD3' ' N ' ' A' ' 62' ' ' GLU . 21.4 Cg_exo -65.32 142.86 74.65 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.615 2.21 . . . . 0.0 112.218 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.44 -80.37 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.699 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -116.08 174.46 6.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.849 0.357 . . . . 0.0 111.24 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -154.21 69.18 6.11 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.975 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.28 105.88 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.719 2.279 . . . . 0.0 112.399 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -71.87 100.91 1.12 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.418 2.078 . . . . 0.0 112.28 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -142.06 159.72 41.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.975 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 90.7 mt -60.14 163.23 8.46 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.963 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -59.38 -154.23 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.489 2.126 . . . . 0.0 112.249 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 66.03 71.32 0.41 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.389 0.614 . . . . 0.0 110.746 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 165.18 -35.03 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.415 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.3 pp -96.24 -33.99 11.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.834 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.2 mp -66.66 -26.46 67.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.04 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.25 -47.1 6.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.542 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -80.41 80.97 6.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.863 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -98.91 -60.14 1.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.727 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -98.28 60.07 1.38 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.86 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.5 t -138.7 -47.06 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.046 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.485 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -66.0 -49.98 54.52 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.177 179.943 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 81' ' ' SER . 45.2 Cg_endo -93.45 -141.15 0.02 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.664 2.909 . . . . 0.0 111.708 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.432 ' H ' ' HB2' ' A' ' 82' ' ' PRO . 35.3 t80 -121.64 130.41 53.46 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.83 0.347 . . . . 0.0 110.917 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -173.35 87.73 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.824 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.92 -53.32 2.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.887 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -139.62 94.47 2.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.944 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -105.28 136.36 44.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.897 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -123.52 -43.22 2.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.074 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 130.67 -164.56 23.05 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.537 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -145.38 -45.02 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.497 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.8 t -67.4 160.91 26.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.753 0.311 . . . . 0.0 110.943 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.9 m -115.77 141.41 48.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.952 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.2 p -65.92 142.21 17.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.078 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 101.06 -34.01 5.98 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.479 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.4 m95 -114.48 65.07 0.67 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.888 0.375 . . . . 0.0 110.872 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -173.21 50.59 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.808 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.8 t -155.2 111.88 2.28 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.783 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -68.21 157.13 63.12 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.428 2.085 . . . . 0.0 112.319 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.21 -27.59 24.12 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.597 2.198 . . . . 0.0 112.347 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -106.93 98.57 8.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.074 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 25.0 m -93.9 154.41 40.81 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.93 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.94 167.06 25.76 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.619 2.213 . . . . 0.0 112.261 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -104.42 82.91 1.98 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.923 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 58.01 104.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.971 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 4.8 ttt85 -151.91 154.96 37.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.85 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.6 142.33 24.41 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.866 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -55.89 -166.41 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.39 2.06 . . . . 0.0 112.345 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -150.41 33.57 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.811 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 87.4 p -108.53 125.24 32.26 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.873 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.31 -167.88 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.433 2.089 . . . . 0.0 112.339 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 64.56 115.98 0.01 OUTLIER Glycine 0 CA--C 1.519 0.302 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.471 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.94 -177.11 0.41 Allowed 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.452 2.101 . . . . 0.0 112.431 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -81.09 142.95 52.05 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.865 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.89 59.81 5.88 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.539 2.159 . . . . 0.0 112.262 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 59.0 ttp180 -147.1 157.59 43.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.84 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -158.32 50.76 0.4 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.864 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -162.43 -44.16 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.983 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 26.5 t 62.89 -80.98 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.991 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.0 134.3 33.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.833 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.96 -175.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.995 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -131.79 82.99 2.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.009 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -82.49 150.87 26.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.961 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 18.7 t -150.37 159.34 4.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.022 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.2 171.54 14.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.048 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -134.63 31.54 3.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.825 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.82 41.91 0.94 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.909 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.5 ttm 178.89 -36.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.939 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.12 -165.96 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.251 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -168.61 137.76 2.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.66 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.475 ' HB ' HG21 ' A' ' 172' ' ' ILE . 2.1 p -110.25 158.89 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.314 0.578 . . . . 0.0 111.484 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.3 m -163.67 151.43 12.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.473 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 11.8 ptt-85 -123.57 91.76 3.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.879 0.371 . . . . 0.0 111.171 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -81.83 175.15 10.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.703 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 1.1 t -135.52 147.87 48.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.832 0.348 . . . . 0.0 111.016 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 73.3 p -119.96 154.22 55.38 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.823 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -54.54 -22.69 28.91 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.56 2.173 . . . . 0.0 112.449 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 22.0 p -88.46 -37.61 15.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.839 0.352 . . . . 0.0 111.179 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -79.29 112.63 29.89 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.992 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -88.76 -72.73 0.0 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 122.796 2.331 . . . . 0.0 112.421 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.41 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.0 OUTLIER -73.43 -62.33 1.22 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.175 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.41 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 29.9 Cg_endo -63.58 173.5 4.43 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.513 2.142 . . . . 0.0 112.332 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -141.03 158.6 43.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.985 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -79.82 101.41 8.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.89 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.29 105.07 7.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.891 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.415 ' HG3' ' CZ ' ' A' ' 156' ' ' PHE . 0.1 OUTLIER -111.0 130.66 55.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.4 ' CD1' ' CD1' ' A' ' 172' ' ' ILE . 24.5 mt -129.98 115.63 34.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.075 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 2.9 m -95.2 136.7 35.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.953 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -116.83 148.58 41.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.175 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.59 30.55 1.98 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.357 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.27 44.51 1.68 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.114 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 118.84 22.2 3.66 Favored Glycine 0 N--CA 1.452 -0.282 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.107 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 58.89 62.05 1.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.123 0.487 . . . . 0.0 110.818 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.63 162.27 15.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.882 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.21 94.21 0.81 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.069 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 32.9 m -87.07 120.23 36.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.328 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.415 ' CZ ' ' HG3' ' A' ' 145' ' ' GLU . 0.3 OUTLIER -104.18 90.03 3.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.75 179.868 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.2 mt -102.75 168.96 8.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.961 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -137.44 103.35 5.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.838 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -57.53 173.49 0.27 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.5 tttp -79.86 -71.41 0.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.989 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -85.08 170.89 12.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.873 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -81.04 -35.56 31.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.948 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -73.33 -40.14 64.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.953 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 168' ' ' TRP . 0.3 OUTLIER -66.11 -41.4 90.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.43 179.718 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -64.76 -42.97 94.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.767 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.9 mtt180 -70.43 -43.97 68.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.225 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -34.53 77.84 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.327 0.584 . . . . 0.0 109.502 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . 0.546 ' O ' HG13 ' A' ' 172' ' ' ILE . 7.4 m95 -68.68 -59.83 2.84 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.595 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . 0.456 ' O ' HG11 ' A' ' 130' ' ' VAL . . . -47.13 -57.61 4.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.161 0.505 . . . . 0.0 110.881 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.46 -39.0 58.97 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.438 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -67.66 -41.61 83.51 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.152 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 168' ' ' TRP . 12.7 mt -62.0 -23.29 31.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 177.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.424 ' N ' HG11 ' A' ' 130' ' ' VAL . 7.0 tt0 -81.17 -28.55 34.95 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.265 179.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.92 -45.12 75.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.375 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -74.87 -34.44 62.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.188 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . 0.409 ' CD1' ' CG2' ' A' ' 172' ' ' ILE . 82.8 mt -85.77 -7.36 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.33 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -85.85 25.09 6.95 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.515 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.6 t . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.919 -179.974 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 120.936 0.398 . . . . 0.0 111.048 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -71.65 174.49 6.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.861 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -170.46 -83.06 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.517 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.59 -74.05 0.62 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.811 0.338 . . . . 0.0 110.851 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.82 147.01 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.918 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -101.48 142.63 24.99 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.015 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -63.83 152.34 81.12 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.626 2.218 . . . . 0.0 112.272 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -84.15 152.53 24.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.943 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 70.7 p -142.55 142.91 32.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.95 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -150.75 132.0 3.75 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.415 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.4 mt -64.84 119.45 10.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.871 0.367 . . . . 0.0 111.04 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -134.33 158.8 42.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.787 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -92.5 157.75 16.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.969 0.414 . . . . 0.0 110.985 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.4 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 14.3 tp -134.81 130.29 35.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.659 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.489 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 12.9 ttp180 -69.57 168.86 13.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.655 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.411 ' HB3' ' HB3' ' A' ' 26' ' ' ARG . 9.2 t -143.37 157.4 44.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.901 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 140.18 -100.25 0.27 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.54 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 60.96 179.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.834 0.349 . . . . 0.0 111.122 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.27 86.1 1.55 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.737 -0.745 . . . . 0.0 112.513 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.2 t -166.1 83.8 0.3 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.856 0.36 . . . . 0.0 110.867 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 90.37 -72.11 2.01 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.514 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -154.48 155.74 35.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.909 0.385 . . . . 0.0 111.052 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -134.48 70.0 0.52 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.415 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -94.39 23.21 33.03 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.669 -0.776 . . . . 0.0 112.644 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 60.41 112.18 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.802 0.334 . . . . 0.0 111.014 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.431 ' HD3' ' HG2' ' A' ' 72' ' ' GLU . 10.2 ttp-105 -140.95 65.0 1.41 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.84 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.489 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.7 m95 -50.41 173.9 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.994 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -169.28 166.78 10.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.875 0.369 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -90.81 130.5 36.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.853 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.6 m -149.93 125.13 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.367 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 tp -69.8 135.1 49.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.625 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.3 mp -103.93 113.97 27.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.964 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.71 81.14 8.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.766 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.6 tp -73.7 117.08 15.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.105 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.97 138.95 54.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.964 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.88 -23.9 47.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.222 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.33 -31.93 22.74 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.975 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -172.67 174.22 3.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.205 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.2 mt -111.26 115.32 29.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.864 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 63.9 m -120.27 130.74 54.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.841 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.7 t -111.86 159.34 11.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.169 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.0 t -155.65 153.34 26.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.495 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -69.41 50.68 0.73 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.736 2.291 . . . . 0.0 112.695 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 43.66 30.62 0.38 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.875 0.369 . . . . 0.0 111.438 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.78 101.61 12.95 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.935 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -70.2 125.28 14.83 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.396 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 60.49 92.68 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 120.665 0.269 . . . . 0.0 110.806 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.64 178.8 2.48 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.45 2.1 . . . . 0.0 112.379 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -123.95 93.1 0.46 Allowed Glycine 0 CA--C 1.518 0.255 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.532 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -68.93 -12.25 33.92 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.636 2.224 . . . . 0.0 112.544 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.461 ' CB ' ' CD ' ' A' ' 52' ' ' PRO . 2.8 mt-10 -160.06 -65.69 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.922 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 51' ' ' GLU . 57.5 Cg_endo -71.0 -169.23 0.38 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.326 2.017 . . . . 0.0 112.188 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -119.17 122.74 29.31 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.804 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.71 115.2 4.2 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.351 2.034 . . . . 0.0 112.333 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.02 155.24 20.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.145 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -124.63 136.41 53.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.916 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.5 mt -87.54 130.19 34.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.911 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -144.4 104.27 4.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.864 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -105.97 -71.59 0.8 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.466 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -110.66 102.64 11.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.821 0.343 . . . . 0.0 111.02 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.1 163.03 20.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.166 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -86.57 108.16 16.82 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.914 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.95 95.85 0.43 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.491 2.128 . . . . 0.0 112.332 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -170.94 91.55 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.47 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -145.55 99.83 3.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.915 0.388 . . . . 0.0 111.029 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.406 ' N ' ' HD2' ' A' ' 67' ' ' PRO . . . -72.97 -59.65 2.13 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.254 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.406 ' HD2' ' N ' ' A' ' 66' ' ' ALA . 73.9 Cg_endo -76.32 137.01 18.41 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 122.867 2.378 . . . . 0.0 112.282 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -57.6 83.12 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.41 2.073 . . . . 0.0 112.248 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.06 154.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.946 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.81 119.76 58.94 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.784 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -66.86 -171.66 0.28 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.462 2.108 . . . . 0.0 112.39 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.431 ' HG2' ' HD3' ' A' ' 26' ' ' ARG . 1.2 mt-10 68.87 74.24 0.26 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.476 0.655 . . . . 0.0 110.836 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 168.33 -50.92 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.537 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.52 -35.37 15.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.63 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.13 -14.99 62.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.421 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -30.73 67.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.844 0.354 . . . . 0.0 110.958 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -77.82 64.12 3.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.812 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.37 -23.32 26.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.172 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -96.32 30.98 2.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.094 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 20.6 t -118.07 -29.34 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.387 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.438 ' N ' ' HD2' ' A' ' 82' ' ' PRO . 0.1 OUTLIER -54.86 -54.77 45.95 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.34 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 81' ' ' SER . 73.0 Cg_endo -78.05 56.07 5.57 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 122.91 2.406 . . . . 0.0 112.647 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 61.32 123.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.157 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -171.14 102.67 0.21 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.848 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.54 70.17 0.64 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.817 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -135.29 129.75 34.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.859 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 32.8 t -130.61 -68.44 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.933 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 60.01 173.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.075 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 160.16 -51.96 0.36 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.47 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 65.69 -107.18 1.82 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.461 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.1 t -176.38 156.17 1.53 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.841 0.353 . . . . 0.0 110.928 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.3 p -138.47 139.95 39.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.836 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.5 p -71.66 123.02 25.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.145 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -155.36 -55.54 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.454 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 41.8 p90 -109.35 41.01 1.73 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.853 0.359 . . . . 0.0 110.771 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.1 t70 61.78 35.45 16.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.934 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.45 129.91 45.53 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.861 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.58 131.35 14.71 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.481 2.121 . . . . 0.0 112.358 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.82 -25.6 16.68 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.385 2.057 . . . . 0.0 112.298 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.57 122.32 12.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.202 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 95.5 p -138.25 115.6 9.26 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.885 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -58.06 122.48 11.78 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.547 2.164 . . . . 0.0 112.298 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.7 mt -132.57 132.15 42.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.925 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -95.74 119.53 34.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.865 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -113.46 -32.32 6.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.062 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 63.66 89.1 0.11 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.866 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -51.56 -54.75 4.82 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.634 2.223 . . . . 0.0 112.391 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.3 m -59.66 -172.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.963 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.9 m 62.98 144.66 0.08 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.014 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.92 146.08 36.95 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.555 2.17 . . . . 0.0 112.349 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -109.6 -69.95 0.64 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.449 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.01 146.91 35.43 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.56 2.173 . . . . 0.0 112.288 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.16 89.43 0.11 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.813 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -68.49 -168.63 0.23 Allowed 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.538 2.159 . . . . 0.0 112.304 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 20.3 mtm180 -75.53 106.43 7.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.899 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.427 ' O ' ' CB ' ' A' ' 117' ' ' LEU . 24.7 m-80 -80.75 153.03 28.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.828 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.427 ' CB ' ' O ' ' A' ' 116' ' ' ASN . 0.2 OUTLIER 83.2 -38.5 0.08 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.561 -179.847 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 24.9 t 68.01 -72.13 0.1 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.801 0.334 . . . . 0.0 111.098 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -95.72 154.97 16.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.88 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -85.67 169.96 12.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.089 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.32 159.74 15.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.802 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -147.67 135.28 20.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.881 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 19.7 t -139.68 140.15 37.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.135 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.01 135.74 37.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.832 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 mp -99.19 31.49 3.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.864 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -139.41 38.12 2.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.739 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.3 mtt 179.27 -35.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.063 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.8 -165.97 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.322 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -170.04 113.67 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.665 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.474 ' CG2' ' N ' ' A' ' 131' ' ' SER . 2.0 p -88.14 158.8 3.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.322 0.582 . . . . 0.0 111.439 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 2.6 m -164.65 149.78 9.84 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.801 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 7.0 ptt85 -126.67 104.04 7.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.012 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.15 156.01 17.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.753 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 61.1 m -81.83 141.02 33.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.912 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.23 170.34 16.52 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.759 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -50.68 -27.88 21.0 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.618 2.212 . . . . 0.0 112.445 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -126.82 -43.9 1.68 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.957 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.1 81.97 0.23 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.879 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.92 -24.5 24.29 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.576 2.184 . . . . 0.0 112.418 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.427 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 1.5 mt-10 -175.31 -62.44 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.804 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 44.4 Cg_endo -68.07 178.49 3.5 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.463 2.108 . . . . 0.0 112.225 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 9.2 mtt-85 -123.59 152.59 41.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.888 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -73.97 100.92 3.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.949 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.83 138.1 34.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.949 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.418 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.0 OUTLIER -153.66 139.91 18.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.82 179.952 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 24.9 mt -134.1 125.1 47.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.241 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.47 126.18 49.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.78 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -102.78 145.53 29.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.361 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.75 30.65 2.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.171 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -118.61 46.07 1.91 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.38 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.39 23.11 2.69 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.356 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.43 60.66 2.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.126 0.489 . . . . 0.0 110.94 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.16 160.65 16.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.9 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.23 94.03 0.8 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.078 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 6.9 m -89.48 112.67 24.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.246 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.418 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 15.6 m-85 -97.2 115.99 28.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.731 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.4 mt -125.66 165.61 18.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.078 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.447 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.1 OUTLIER -140.43 96.81 3.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.748 179.863 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -57.33 162.88 2.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.203 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.98 -32.23 17.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.924 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -98.13 164.27 12.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.822 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -88.65 -55.8 3.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.91 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.81 85.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.159 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 1.8 t -63.97 -48.16 77.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.79 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -60.12 -38.61 83.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.011 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 74.3 mtp180 -71.12 -47.33 58.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.436 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.06 -28.4 69.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.176 179.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 7.4 m95 -72.44 -52.07 17.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.908 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . 0.406 ' O ' HG13 ' A' ' 130' ' ' VAL . . . -56.9 -47.62 80.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.304 0.573 . . . . 0.0 110.53 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.96 -43.12 97.04 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.64 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.95 -40.72 78.76 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.997 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.43 HG21 ' CD1' ' A' ' 176' ' ' ILE . 19.1 mt -60.21 -24.63 31.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.45 ' N ' HG13 ' A' ' 130' ' ' VAL . 30.6 tt0 -83.84 -27.0 29.03 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.324 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.56 -47.98 68.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.141 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -69.96 -42.09 73.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.86 179.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . 0.43 ' CD1' HG21 ' A' ' 172' ' ' ILE . 75.9 mt -77.57 -8.94 12.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.36 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -85.89 25.67 6.57 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.393 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 3.6 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.858 179.986 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.859 0.361 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -168.65 84.73 0.17 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.894 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.06 36.6 90.92 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.609 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -119.22 86.31 2.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.817 0.341 . . . . 0.0 110.957 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -68.45 102.86 1.52 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.864 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -110.13 92.6 13.48 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.166 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -68.09 152.87 76.09 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.584 2.19 . . . . 0.0 112.297 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -101.25 139.18 37.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.952 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.0 p -129.36 167.98 16.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.02 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -167.05 132.75 2.7 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.48 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.5 103.22 0.63 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.762 0.315 . . . . 0.0 110.895 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -120.19 146.69 45.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.811 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -70.64 169.84 13.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.922 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.422 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 37.6 tp -157.57 130.42 7.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.697 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.466 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.57 -171.65 0.4 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.635 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.6 t -178.29 101.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.905 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -150.87 -176.52 23.85 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.413 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -162.8 90.31 0.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.837 0.351 . . . . 0.0 111.092 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 128.93 -45.43 1.14 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.618 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.2 m -100.61 141.82 32.94 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.833 0.349 . . . . 0.0 110.838 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.92 -32.72 4.92 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.482 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -153.34 30.74 0.48 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.81 0.338 . . . . 0.0 111.089 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -120.53 33.46 4.47 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.472 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.16 104.95 2.96 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.471 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -140.07 174.84 10.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.768 0.318 . . . . 0.0 110.952 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.405 ' O ' ' CD1' ' A' ' 27' ' ' TRP . 0.2 OUTLIER -97.88 173.75 6.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.939 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.466 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 17.1 m95 -154.82 173.64 16.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.929 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -178.09 168.45 1.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.926 0.393 . . . . 0.0 110.844 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -95.09 129.02 42.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.866 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 27.7 m -136.65 138.39 46.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.177 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 17.4 tp -74.33 123.44 24.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.658 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.04 114.49 26.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.108 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -94.47 85.74 4.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.575 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tp -84.93 103.7 14.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.136 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -91.21 155.96 18.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.706 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -57.43 -16.73 10.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.816 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.06 28.95 1.1 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.432 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 179.55 114.75 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.858 0.361 . . . . 0.0 111.514 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.2 tp -95.92 82.44 3.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.397 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.406 HG21 ' CG ' ' A' ' 122' ' ' HIS . 27.6 m -92.49 114.19 26.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.204 -179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.412 ' CG2' ' HB2' ' A' ' 121' ' ' LYS . 8.0 t -83.41 157.35 3.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.675 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -159.9 163.09 23.42 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.906 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.35 147.41 59.0 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.534 2.156 . . . . 0.0 112.133 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -95.83 43.56 1.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.984 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.3 p30 44.82 37.12 2.13 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.513 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -78.22 136.35 17.86 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.438 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -145.61 154.26 52.1 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.683 0.278 . . . . 0.0 110.91 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -62.16 179.03 0.67 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.528 2.152 . . . . 0.0 112.208 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.409 ' N ' ' HD2' ' A' ' 50' ' ' PRO . . . 168.75 -56.64 0.21 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.548 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 49' ' ' GLY . 60.9 Cg_endo -72.98 -6.05 18.3 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.545 2.163 . . . . 0.0 112.694 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.55 96.36 4.45 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.833 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.94 111.85 2.54 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.409 2.073 . . . . 0.0 112.354 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -123.29 124.0 26.47 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.84 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.48 154.09 65.16 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.375 2.05 . . . . 0.0 112.325 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -149.48 -176.49 5.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.074 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 64.55 -78.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.945 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 42.44 43.93 3.28 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.508 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -62.65 113.07 2.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 153.07 97.24 0.15 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.521 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.29 96.45 9.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.83 0.348 . . . . 0.0 111.149 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -157.58 124.5 5.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.091 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 59.78 82.34 0.23 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.921 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.19 162.76 1.86 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.553 2.169 . . . . 0.0 112.289 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -176.34 -52.97 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.451 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -81.49 94.67 6.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.779 0.323 . . . . 0.0 111.064 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.512 ' CB ' ' CD ' ' A' ' 67' ' ' PRO . . . -114.8 -68.53 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.542 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.512 ' CD ' ' CB ' ' A' ' 66' ' ' ALA . 58.4 Cg_endo -72.24 111.41 3.19 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.751 2.301 . . . . 0.0 112.409 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.15 -161.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.495 2.13 . . . . 0.0 112.385 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -96.2 176.25 6.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.079 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -118.66 83.82 23.11 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.942 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.5 -167.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.635 2.223 . . . . 0.0 112.275 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 66.01 72.05 0.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.376 0.607 . . . . 0.0 110.801 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 172.06 -46.53 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.736 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.94 -31.34 17.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.775 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mp -74.27 -37.24 63.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.985 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.8 mp -61.15 -34.45 75.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.936 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 62.1 mm-40 -97.82 32.45 2.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.012 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -107.55 -0.2 22.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.421 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -98.29 31.96 2.63 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.82 0.343 . . . . 0.0 111.03 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 38.8 t -143.62 -72.13 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.152 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.6 t 61.72 148.32 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.912 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -83.44 48.38 2.64 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.69 2.26 . . . . 0.0 112.524 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -177.52 37.42 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.954 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.408 ' O ' ' CD1' ' A' ' 84' ' ' PHE . 52.9 p90 -74.64 123.14 24.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -114.15 171.17 7.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -108.95 92.99 4.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.906 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.2 p -167.74 173.17 8.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.859 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -81.09 151.82 28.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.124 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -155.53 36.57 0.63 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.412 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -152.16 123.73 1.52 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.492 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.5 t -178.81 -38.33 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.86 0.362 . . . . 0.0 110.996 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 64.98 122.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.875 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 9.6 p -87.86 151.26 3.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.184 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 156.06 44.13 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.524 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 10.9 t-105 62.66 85.32 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.818 0.342 . . . . 0.0 110.963 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.5 t70 62.66 30.88 16.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.133 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 48.8 p 54.1 101.04 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.199 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_exo -51.64 106.6 0.14 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.543 2.162 . . . . 0.0 112.315 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -78.16 -26.85 6.01 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.586 2.19 . . . . 0.0 112.401 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -142.99 144.06 32.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.177 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.453 ' CB ' ' HD3' ' A' ' 102' ' ' PRO . 0.5 OUTLIER 174.97 -54.53 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.028 179.853 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.453 ' HD3' ' CB ' ' A' ' 101' ' ' SER . 51.7 Cg_exo -52.09 147.96 25.5 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.826 2.351 . . . . 0.0 112.248 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 3.5 pp -178.17 -39.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.901 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -111.53 109.01 18.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.879 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -158.39 87.27 0.89 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.88 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -82.81 131.87 53.13 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.907 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -73.56 146.14 38.63 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.506 2.137 . . . . 0.0 112.268 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.03 31.19 0.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.808 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.32 154.93 82.07 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.88 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -69.86 143.77 51.38 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.663 2.242 . . . . 0.0 112.309 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 96.5 144.95 18.18 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.418 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.13 174.24 0.18 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.527 2.151 . . . . 0.0 112.276 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -100.26 108.6 53.32 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.859 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -49.4 118.72 3.87 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.463 2.108 . . . . 0.0 112.417 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.77 83.82 1.35 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.808 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -74.2 139.66 44.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.917 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 3.5 tt 60.64 157.88 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.936 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 98.6 p -155.17 -45.81 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.979 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -104.06 148.13 26.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.887 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -73.06 163.66 27.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.224 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.412 ' HB2' ' CG2' ' A' ' 41' ' ' VAL . 2.0 mtpp -110.41 74.53 0.88 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.049 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.406 ' CG ' HG21 ' A' ' 40' ' ' THR . 19.6 m-70 -73.05 102.7 3.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.975 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 24.7 t -99.94 115.65 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.965 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 72.1 p -59.74 137.44 58.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.848 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -98.64 53.96 1.03 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.807 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 27.1 mttt -164.45 37.3 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.006 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.51 -39.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.38 . . . . 0.0 110.949 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.15 -169.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.149 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -170.11 123.48 0.71 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.495 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.478 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.5 p -94.66 157.65 3.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.492 0.663 . . . . 0.0 111.615 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.457 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.2 OUTLIER -170.31 127.67 0.83 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.696 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 18.3 ptt-85 -83.26 96.49 8.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.947 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 30.3 mtt180 -94.48 -176.91 4.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.034 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.21 -175.33 3.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.775 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.442 ' CB ' ' HD3' ' A' ' 136' ' ' PRO . 0.1 OUTLIER -157.62 -55.1 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.234 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . 0.442 ' HD3' ' CB ' ' A' ' 135' ' ' THR . 1.0 OUTLIER -83.49 8.3 4.7 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.766 2.311 . . . . 0.0 112.508 -179.888 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.5 p 67.91 29.73 6.45 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.082 0.467 . . . . 0.0 110.456 -179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -109.36 92.75 12.09 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.883 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.59 78.36 1.66 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.443 2.095 . . . . 0.0 112.488 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.489 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.2 OUTLIER -152.86 -68.1 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.984 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.489 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 66.8 Cg_endo -73.2 -43.67 0.68 Allowed 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.193 1.929 . . . . 0.0 112.062 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? 62.74 124.51 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.008 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.427 ' CD1' HG23 ' A' ' 135' ' ' THR . 7.7 m-85 -80.96 114.86 20.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.777 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.0 mt -69.94 94.02 0.82 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.97 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -99.9 123.67 44.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.78 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 22.5 mt -128.81 120.8 53.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.212 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -101.91 129.74 48.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.775 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -110.98 146.46 36.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.192 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.1 30.84 2.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.283 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -114.95 44.92 1.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.062 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.93 20.93 3.3 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.692 -0.686 . . . . 0.0 112.249 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.406 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.5 mm-40 58.69 61.33 2.23 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.066 0.46 . . . . 0.0 110.949 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -92.85 157.96 16.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.682 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -161.15 92.78 0.93 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.225 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.8 m -84.49 127.17 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.032 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -109.21 88.72 2.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.742 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.5 mt -95.95 153.57 17.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.901 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.439 ' CB ' ' CH2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER -127.83 94.02 3.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.841 -179.893 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.24 143.53 44.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.123 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.07 -32.95 51.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.816 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.12 168.6 10.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.848 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -88.72 -61.3 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.878 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -59.7 -31.96 70.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.075 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -49.82 70.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.745 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -60.44 -41.87 94.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.183 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -71.33 -40.38 70.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.545 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 94.4 p -68.59 -33.89 74.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.097 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 7.4 m95 -74.28 -49.1 24.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.839 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -58.57 -49.76 76.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.328 0.585 . . . . 0.0 110.278 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.65 -42.02 96.0 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.425 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.18 -40.68 77.96 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.77 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.45 HG22 ' CD1' ' A' ' 176' ' ' ILE . 11.2 mt -60.33 -24.43 30.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.478 ' N ' HG11 ' A' ' 130' ' ' VAL . 6.3 tp60 -81.43 -29.88 33.7 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.008 -0.997 . . . . 0.0 110.069 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.79 -49.8 71.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.119 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.24 -42.14 84.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.713 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . 0.45 ' CD1' HG22 ' A' ' 172' ' ' ILE . 80.5 mt -76.83 -5.55 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.42 179.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -87.13 26.12 7.17 Favored Glycine 0 C--N 1.332 0.359 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.454 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.144 -0.931 . . . . 0.0 110.963 -179.928 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.758 0.313 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.7 m -74.48 138.77 43.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.946 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -177.04 84.59 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.501 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 13.6 ttp85 -97.3 23.18 7.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.679 0.276 . . . . 0.0 111.096 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.89 92.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.927 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -136.24 131.17 18.55 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.041 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.91 129.63 11.7 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.512 2.141 . . . . 0.0 112.366 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.4 ttt85 -72.37 141.95 48.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.833 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 77.4 p -143.34 165.13 28.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.978 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 173.8 135.52 2.03 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.421 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.8 mt -68.62 122.36 18.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 0.0 110.935 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -131.91 158.41 41.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.723 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.81 150.95 20.82 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.071 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 7.3 tp -134.29 137.54 44.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.577 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.516 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.7 -164.32 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.82 -179.717 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -159.78 129.67 5.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.759 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 159.66 -25.39 0.32 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.565 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 75.56 -68.45 0.2 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.895 0.379 . . . . 0.0 111.292 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.11 -140.34 3.21 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.592 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.6 m -57.66 137.45 56.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.323 . . . . 0.0 111.033 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 122.12 39.47 0.55 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.495 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.9 77.32 0.08 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.835 0.35 . . . . 0.0 111.168 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -123.99 43.38 1.42 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.464 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 171.09 -65.43 0.15 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.518 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 62.78 137.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.86 0.362 . . . . 0.0 110.871 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -149.33 73.96 1.22 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.023 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.516 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 24.7 m95 -54.42 108.77 0.41 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.902 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.16 152.54 24.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.065 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.97 135.01 37.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.982 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 33.0 m -148.25 125.75 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.26 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.8 tp -69.8 135.94 50.26 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.596 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -104.53 142.0 35.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.747 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.0 m -123.12 94.53 4.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.884 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HB2' ' CZ3' ' A' ' 168' ' ' TRP . 0.4 OUTLIER -85.55 96.81 9.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.815 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -107.63 137.8 45.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.951 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -57.1 -23.0 43.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.081 0.467 . . . . 0.0 111.226 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 89.9 m-20 -85.11 -31.1 23.52 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -175.79 168.76 3.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.021 0.439 . . . . 0.0 111.315 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -111.0 108.77 18.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.417 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.414 HG21 ' CD2' ' A' ' 122' ' ' HIS . 8.3 m -114.2 139.23 49.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.254 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.8 t -117.46 159.69 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.881 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.1 t -156.34 152.55 23.36 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.708 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.08 47.71 1.06 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.485 2.123 . . . . 0.0 112.485 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 50.75 29.25 4.12 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.118 0.485 . . . . 0.0 111.11 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -138.8 74.17 1.46 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.705 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -116.19 107.39 1.65 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.496 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -142.29 156.37 64.25 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 120.66 0.267 . . . . 0.0 110.939 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.56 163.85 33.31 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.507 2.138 . . . . 0.0 112.255 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.66 79.73 1.45 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.455 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.39 154.94 70.86 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.611 2.207 . . . . 0.0 112.277 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -148.96 100.41 3.44 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.852 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -49.24 132.86 29.31 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.507 2.138 . . . . 0.0 112.421 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -68.54 127.07 93.27 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.847 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.51 176.87 8.71 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.442 2.095 . . . . 0.0 112.302 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -84.12 158.34 21.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.121 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 60.85 165.49 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.36 -33.0 70.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.959 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -123.98 155.41 38.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.925 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.69 -81.07 1.12 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.517 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -102.73 103.15 13.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.835 0.35 . . . . 0.0 111.097 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 59.54 160.92 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.13 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.556 ' N ' ' CD ' ' A' ' 63' ' ' PRO . 2.1 mp0 -76.43 -43.07 3.29 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.486 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.556 ' CD ' ' N ' ' A' ' 62' ' ' GLU . 51.6 Cg_exo -52.35 144.76 38.64 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.587 2.191 . . . . 0.0 112.306 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -138.85 34.84 2.05 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.797 -0.715 . . . . 0.0 112.577 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.75 115.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.816 0.341 . . . . 0.0 111.085 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 60.61 87.53 0.13 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.06 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -49.08 105.04 0.09 OUTLIER 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.658 2.239 . . . . 0.0 112.46 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.08 165.96 31.33 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.424 2.083 . . . . 0.0 112.301 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -89.15 135.36 33.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -102.12 105.65 43.68 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.03 -174.02 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.34 2.027 . . . . 0.0 112.315 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 64.56 70.93 0.48 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.39 0.614 . . . . 0.0 110.671 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 167.47 -45.52 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.536 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -93.54 -30.3 15.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.684 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.81 -15.27 60.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.508 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.0 tp -70.94 -43.83 67.36 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.837 0.351 . . . . 0.0 110.867 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -69.44 -74.82 0.12 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.856 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 69.66 -64.64 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.111 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -94.84 36.15 1.21 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.19 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.5 t -144.64 -68.32 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.025 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.48 167.11 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.991 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -68.64 60.02 1.14 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.913 2.409 . . . . 0.0 112.286 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -159.38 31.88 0.2 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.016 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -128.08 -176.53 3.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.858 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.6 ttpp -93.37 -34.58 13.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -125.87 174.64 8.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.871 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.1 m -110.01 -72.66 0.71 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.904 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -87.25 -72.01 0.53 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.068 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 98.62 147.34 21.97 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.451 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 109.21 -115.13 4.19 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.454 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.3 t -143.72 133.57 23.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.864 0.364 . . . . 0.0 110.858 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.8 m -90.51 135.08 33.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.94 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.4 p -91.32 49.62 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.087 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -116.14 27.78 7.97 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.546 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 7.6 m95 -114.37 31.21 6.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.921 0.391 . . . . 0.0 110.881 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -157.87 45.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.955 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.0 m -143.22 154.96 61.69 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.84 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -68.44 148.93 74.34 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.422 2.081 . . . . 0.0 112.363 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -77.7 59.14 6.7 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.489 2.126 . . . . 0.0 112.328 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -149.82 155.65 40.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.141 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -137.51 171.79 7.91 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.86 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_exo -51.11 171.92 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.541 2.161 . . . . 0.0 112.336 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.13 145.45 24.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.888 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -99.26 141.27 32.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.859 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -174.54 134.14 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.853 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.422 ' CB ' ' HD3' ' A' ' 107' ' ' PRO . 0.0 OUTLIER -87.75 -51.23 0.41 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.947 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.422 ' HD3' ' CB ' ' A' ' 106' ' ' GLN . 3.1 Cg_exo -74.83 108.97 2.83 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.716 2.277 . . . . 0.0 112.073 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 13.5 m -163.55 171.83 15.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.087 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -135.23 150.12 71.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.88 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.96 179.17 4.0 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.516 2.144 . . . . 0.0 112.417 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 174.37 -75.84 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.442 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.71 -166.23 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.604 2.203 . . . . 0.0 112.305 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.93 117.47 61.47 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.85 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.95 -172.89 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.447 2.098 . . . . 0.0 112.341 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.0 146.83 29.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.948 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 60.17 177.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.87 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 15.8 tp -96.91 102.94 14.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.909 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.7 p -103.36 -31.67 9.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.897 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -104.75 176.7 5.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.902 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.17 169.83 16.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.082 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -129.3 91.18 3.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.91 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.414 ' CD2' HG21 ' A' ' 40' ' ' THR . 20.4 m80 -80.22 143.18 33.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.928 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 20.3 t -142.22 140.48 29.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.122 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 1.4 m -76.74 158.52 30.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.936 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -123.18 43.66 2.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.939 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -142.82 35.73 1.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.846 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.25 -36.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.954 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.85 -173.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.316 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -170.04 128.2 0.89 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.682 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.517 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.4 p -105.52 159.52 5.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.321 0.581 . . . . 0.0 111.493 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -165.46 134.22 3.27 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.78 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . 0.4 ' NH1' ' NH2' ' A' ' 142' ' ' ARG . 2.4 ptt180 -99.59 91.88 5.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.098 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.85 -170.24 1.55 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.619 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 28.8 p -143.67 122.65 12.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.969 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 2.0 p -93.25 159.24 35.75 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.791 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.69 -6.05 18.31 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.587 2.191 . . . . 0.0 112.791 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 25.6 p -123.65 30.31 6.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.821 0.344 . . . . 0.0 110.933 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -135.97 79.58 44.56 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.923 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.72 -71.4 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.522 2.148 . . . . 0.0 112.357 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.412 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.4 OUTLIER -72.42 -61.51 1.74 Allowed Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.097 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.412 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 46.0 Cg_endo -68.6 170.1 15.87 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.393 2.062 . . . . 0.0 112.381 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.4 ' NH2' ' NH1' ' A' ' 132' ' ' ARG . 2.8 mtt180 -134.23 -178.5 5.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.903 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.419 ' CE2' ' HB3' ' A' ' 156' ' ' PHE . 5.1 t80 -103.26 114.08 28.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.991 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -95.6 114.63 26.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.852 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.416 ' HG3' ' CE1' ' A' ' 156' ' ' PHE . 43.3 tt0 -120.78 128.71 53.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.994 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 19.6 mt -132.3 110.03 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.168 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.27 122.54 40.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.806 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -105.45 146.57 29.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.24 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.31 30.47 2.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.261 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -115.06 44.95 1.7 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.076 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.54 23.45 2.58 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.17 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.404 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 6.2 mm-40 56.64 59.23 3.66 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.048 0.451 . . . . 0.0 110.978 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -90.58 160.36 15.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.797 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -165.98 95.45 0.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.159 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 11.1 m -90.1 128.46 42.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.167 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.419 ' HB3' ' CE2' ' A' ' 143' ' ' TYR . 20.9 m-85 -115.93 92.42 3.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.67 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.5 mt -98.61 168.18 10.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.128 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.445 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER -134.14 93.47 3.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.571 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -55.28 168.96 0.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.339 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -84.37 -67.27 0.81 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.959 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -90.28 164.57 14.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.943 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.99 -43.24 79.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.837 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -67.74 -32.54 73.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.077 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 62.2 m -66.28 -50.07 64.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.797 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -62.22 -37.51 85.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.911 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 15.0 ttt180 -72.74 -43.86 62.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.387 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.3 t -65.59 -32.9 74.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.945 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . 0.423 ' CZ3' ' HB2' ' A' ' 34' ' ' LEU . 8.5 m95 -74.16 -53.15 10.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.691 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -58.08 -50.78 72.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.339 0.59 . . . . 0.0 110.388 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.74 -38.38 91.84 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.554 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -71.29 -40.21 71.01 Favored 'General case' 0 CA--C 1.511 -0.545 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.999 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . . . . . . . . . 8.4 mt -62.54 -22.7 30.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.517 ' N ' HG11 ' A' ' 130' ' ' VAL . 26.5 tt0 -77.35 -40.47 43.9 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.434 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.36 -37.53 87.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.471 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -76.81 -33.08 58.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.187 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . . . . . . . . . 48.1 mt -73.75 -28.92 25.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.809 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 151.12 -41.96 0.75 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.781 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 14.5 t . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.254 -0.879 . . . . 0.0 111.517 179.935 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.821 0.343 . . . . 0.0 111.076 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.1 -57.52 1.77 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.878 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -103.82 -137.75 9.47 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.491 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.93 -28.56 8.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.756 0.312 . . . . 0.0 110.958 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 60.93 97.22 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.848 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -136.43 102.28 9.75 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.097 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -67.85 135.52 35.61 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.444 2.096 . . . . 0.0 112.234 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.89 152.34 18.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.761 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.9 p -146.13 158.07 43.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.997 0.427 . . . . 0.0 111.219 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -156.11 135.28 4.46 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.266 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 12.9 mt -62.92 106.69 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.778 0.323 . . . . 0.0 110.911 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -117.03 170.07 8.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.865 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -107.68 162.68 13.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.016 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.6 tp -137.1 129.66 30.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.553 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.477 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 37.9 ttp180 -69.54 165.07 21.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.874 0.369 . . . . 0.0 110.717 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.8 t -145.92 81.15 1.59 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.944 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -99.82 -72.84 1.03 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.493 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -84.86 73.96 10.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.874 0.369 . . . . 0.0 111.123 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -98.51 -65.87 0.87 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.504 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.3 t -111.08 -33.76 6.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.83 0.347 . . . . 0.0 110.828 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 166.41 -30.99 0.2 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.521 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -167.18 137.94 3.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.939 0.399 . . . . 0.0 111.073 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -153.82 -62.74 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.529 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 116.88 46.91 0.5 Allowed Glycine 0 N--CA 1.453 -0.202 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.535 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 61.25 84.6 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.697 0.284 . . . . 0.0 110.896 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.0 mmt85 -109.44 69.01 0.69 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.859 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.477 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 29.0 m95 -51.12 168.48 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.17 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -148.95 -166.72 2.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.882 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.0 ttp-105 -124.93 110.76 14.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.989 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.6 m -125.35 127.53 72.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.159 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.8 tp -76.04 115.53 15.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.62 121.58 27.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.904 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.7 m -103.61 86.84 2.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.7 tp -78.36 113.35 16.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.819 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.39 148.93 27.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.915 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -64.88 -11.71 40.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.712 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -134.84 16.6 3.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.314 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 179.28 160.04 0.7 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.85 0.357 . . . . 0.0 111.265 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 66.5 tp -124.23 88.71 2.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.557 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.411 HG23 ' CD2' ' A' ' 122' ' ' HIS . 79.4 m -94.29 145.31 24.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.158 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.2 t -125.65 160.21 32.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.019 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 84.5 p -151.9 152.13 29.4 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.539 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -78.93 37.68 0.68 Allowed 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.666 2.244 . . . . 0.0 112.852 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 46.6 29.19 0.89 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.076 0.465 . . . . 0.0 111.325 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.56 119.03 17.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.877 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -83.98 133.36 11.79 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.57 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -89.26 154.03 48.94 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.759 0.314 . . . . 0.0 110.94 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.2 163.25 38.54 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.523 2.148 . . . . 0.0 112.35 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -144.68 -149.61 5.07 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.505 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -51.84 104.64 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.604 2.203 . . . . 0.0 112.353 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 60.94 87.6 0.13 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.84 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.56 176.36 6.72 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.627 2.218 . . . . 0.0 112.253 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -141.7 70.02 25.16 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.85 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.82 -168.07 0.34 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.538 2.159 . . . . 0.0 112.357 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 62.44 118.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.066 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -105.57 162.61 13.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.917 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -109.09 36.67 2.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.838 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -86.32 129.72 34.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.867 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -175.37 -105.31 0.19 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.514 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.4 179.53 5.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.811 0.338 . . . . 0.0 111.069 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -136.05 175.25 9.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.093 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -89.02 111.89 47.64 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.986 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -55.63 160.98 8.44 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.473 2.115 . . . . 0.0 112.274 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 107.53 -43.5 1.68 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.543 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.49 138.42 58.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.827 0.346 . . . . 0.0 111.104 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.61 165.02 8.07 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.044 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.0 110.84 2.91 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.571 2.181 . . . . 0.0 112.323 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.66 -168.25 0.55 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.427 2.085 . . . . 0.0 112.316 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.7 129.13 36.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.82 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.2 mt -61.96 123.35 77.3 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.853 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.583 ' HA ' ' HB2' ' A' ' 75' ' ' LEU . 51.4 Cg_endo -69.09 178.24 4.35 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.452 2.102 . . . . 0.0 112.548 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.426 ' N ' HD12 ' A' ' 75' ' ' LEU . 3.1 pt-20 -157.68 53.06 0.47 Allowed 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.158 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 59.36 28.07 17.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.276 0.56 . . . . 0.0 110.15 -179.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 10.3 tt -150.51 -48.6 0.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.979 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.583 ' HB2' ' HA ' ' A' ' 71' ' ' PRO . 7.1 mp -61.43 -38.04 85.69 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.786 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.1 tp -53.78 -46.57 71.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.119 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 14.4 mp0 -93.85 45.85 1.16 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.901 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -110.3 129.69 55.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.914 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.2 31.51 20.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.985 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.9 t -130.95 -57.54 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.061 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.423 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.1 OUTLIER -79.08 -54.2 1.04 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.736 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 81' ' ' SER . 88.7 Cg_endo -86.3 39.93 0.69 Allowed 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 123.194 2.596 . . . . 0.0 112.655 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER 179.41 134.18 0.09 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 59.7 43.06 16.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.85 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -118.08 -50.79 2.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.925 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -98.25 106.12 18.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.775 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 28.6 t -134.07 -68.81 0.55 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.849 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 59.49 -178.12 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.13 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 110.28 -66.4 0.24 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.526 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -129.61 106.74 0.75 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.513 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.2 t -99.88 116.25 31.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.824 0.345 . . . . 0.0 110.916 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.2 p -103.66 131.96 50.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.87 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.9 p -79.28 130.56 35.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.059 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -135.88 59.38 0.65 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.509 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER 62.34 99.53 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.853 0.358 . . . . 0.0 110.798 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -133.61 53.25 2.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.846 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.67 108.57 43.55 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.921 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -62.85 120.51 8.04 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.544 2.163 . . . . 0.0 112.135 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -62.16 -26.05 77.57 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.457 2.105 . . . . 0.0 111.994 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -126.91 -173.99 3.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.087 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 73.0 m -97.67 112.44 61.43 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.804 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -51.53 -178.16 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.416 2.077 . . . . 0.0 112.34 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.2 mt 62.03 95.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.868 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.52 -168.83 2.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.881 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.23 43.21 1.11 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.967 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -151.1 70.41 8.46 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.875 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.85 164.76 34.68 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.566 2.177 . . . . 0.0 112.333 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.75 -176.43 0.11 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.014 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.56 166.19 7.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.957 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.19 157.54 56.98 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.644 2.23 . . . . 0.0 112.393 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.415 ' N ' ' HD3' ' A' ' 112' ' ' PRO . . . 57.95 62.55 6.18 Favored Glycine 0 CA--C 1.52 0.368 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.611 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . 0.415 ' HD3' ' N ' ' A' ' 111' ' ' GLY . 20.4 Cg_exo -65.67 102.1 0.49 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.672 2.248 . . . . 0.0 112.327 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.503 ' CB ' ' HD3' ' A' ' 114' ' ' PRO . 2.2 mt-30 -135.73 -66.35 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.571 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . 0.503 ' HD3' ' CB ' ' A' ' 113' ' ' GLN . 86.9 Cg_exo -43.45 94.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.687 2.258 . . . . 0.0 112.51 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -114.53 92.48 3.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.107 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -91.57 116.34 28.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.7 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 61.67 82.46 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.691 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 5.7 t -63.75 -35.91 82.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.003 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.87 162.3 23.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.895 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.405 ' O ' ' CE1' ' A' ' 122' ' ' HIS . . . -80.02 157.57 26.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.047 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.44 160.31 17.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.914 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.411 ' CD2' HG23 ' A' ' 40' ' ' THR . 16.9 m80 -152.27 113.01 4.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.77 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.5 t -119.94 133.63 66.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.144 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 13.1 t -75.46 147.11 40.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.812 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 18.1 mt -104.2 38.08 1.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.043 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -128.59 34.29 4.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.792 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.58 -35.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.009 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.56 -173.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.347 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -170.07 111.29 0.43 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.491 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.468 HG12 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -87.45 159.18 3.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.272 0.558 . . . . 0.0 111.406 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 97.8 p -162.05 149.14 13.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.708 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 27.9 ptt85 -118.69 95.79 4.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.965 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -85.37 -167.58 1.89 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.847 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 6.2 p -124.61 156.22 37.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.913 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 60.4 p -121.37 145.98 43.74 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.804 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.7 -30.46 7.69 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.641 2.227 . . . . 0.0 112.337 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 26.1 p -73.6 -33.59 64.67 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.972 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.27 92.78 5.17 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.022 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -82.32 63.35 8.17 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.559 2.172 . . . . 0.0 112.281 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.713 ' HB2' ' HD3' ' A' ' 141' ' ' PRO . 54.4 mt-10 -157.51 -54.71 0.02 OUTLIER Pre-proline 0 CA--C 1.532 0.258 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.607 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.713 ' HD3' ' HB2' ' A' ' 140' ' ' GLU . 23.7 Cg_exo -64.41 -21.84 66.22 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.163 1.908 . . . . 0.0 112.129 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 61.97 151.9 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.962 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -94.0 115.21 27.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.9 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.68 98.24 11.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.77 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -108.39 137.31 46.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.895 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 23.3 mt -137.27 108.81 6.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.144 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.3 m -92.51 135.37 34.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -113.12 144.9 41.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.187 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.55 30.9 1.88 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.304 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -121.44 48.17 1.72 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.129 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.28 18.77 3.68 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.375 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.413 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 4.8 mm-40 58.64 61.67 2.15 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.096 0.474 . . . . 0.0 111.021 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -89.85 163.81 14.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.8 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.85 96.47 0.44 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.068 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.3 m -97.63 121.76 48.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.169 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 156' ' ' PHE . 0.5 OUTLIER -113.05 106.29 14.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.791 179.802 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -111.92 166.23 11.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.067 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.424 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -129.15 109.96 11.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.868 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -68.83 158.76 33.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.076 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -31.5 24.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.95 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -109.32 160.54 16.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.944 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -74.16 -61.78 1.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -58.99 -27.89 65.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.172 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 45.2 t -66.64 -48.43 69.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.699 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -62.12 -42.51 99.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.973 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 40.7 mtt180 -71.27 -40.81 70.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.449 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 32.6 t -67.66 -34.38 76.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.059 0.457 . . . . 0.0 109.939 179.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . 0.417 ' O ' HG12 ' A' ' 172' ' ' ILE . 12.9 m95 -72.5 -52.49 15.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.67 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . 0.41 ' O ' HG12 ' A' ' 130' ' ' VAL . . . -56.53 -45.98 80.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.171 0.51 . . . . 0.0 110.465 179.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.61 -43.98 95.85 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.518 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.36 -40.8 77.26 Favored 'General case' 0 CA--C 1.511 -0.544 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.611 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.425 HG23 ' CD1' ' A' ' 176' ' ' ILE . 12.9 mm -58.67 -24.81 26.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.468 ' N ' HG12 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -84.12 -28.62 27.36 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.2 179.216 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.42 -40.87 77.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.247 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.14 -41.27 58.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.004 179.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . 0.425 ' CD1' HG23 ' A' ' 172' ' ' ILE . 54.0 mt -79.9 -10.29 12.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.268 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -85.55 25.38 6.5 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.367 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.96 -179.97 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.83 0.348 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.5 92.4 7.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.888 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -93.87 -154.49 31.09 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.551 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -108.05 31.56 5.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.772 0.32 . . . . 0.0 110.816 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.47 153.21 32.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.964 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -133.16 98.39 15.65 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.071 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.82 152.05 18.34 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.55 2.166 . . . . 0.0 112.271 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.74 100.31 6.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.869 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 20.7 p -100.65 167.8 10.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.986 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.81 132.05 2.2 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.371 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -59.91 123.46 17.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.864 0.364 . . . . 0.0 110.87 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -136.17 170.13 16.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.801 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -104.29 152.45 22.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.061 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.406 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 26.6 tp -138.71 137.15 36.52 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.564 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.463 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 7.1 ptt180 -69.69 -165.34 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.763 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.0 t -171.42 135.31 0.92 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.977 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 168.0 49.56 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.488 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -107.45 178.39 4.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.899 0.38 . . . . 0.0 111.033 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.8 -78.74 0.61 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.547 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.6 p -162.28 157.64 23.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.849 0.357 . . . . 0.0 110.893 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 127.65 161.74 10.88 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.414 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -149.06 127.78 12.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.852 0.358 . . . . 0.0 111.058 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.92 39.66 85.08 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.628 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -141.89 56.62 0.58 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.401 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.99 125.2 25.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.877 0.37 . . . . 0.0 110.909 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -116.27 74.27 0.89 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.775 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.463 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 18.9 m95 -57.46 101.91 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.026 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -96.06 165.63 12.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.887 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.7 ttp180 -84.68 147.13 27.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.008 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 35.5 m -155.1 144.2 12.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.983 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.9 tp -100.48 124.68 46.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.573 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 mp -89.52 151.27 22.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.915 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.3 t -131.39 98.42 4.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.596 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.89 95.73 9.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.025 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -99.37 142.69 30.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.931 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -59.97 -17.62 39.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.352 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -93.48 -27.87 16.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.974 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -179.94 -170.84 0.16 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.207 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.2 tp -115.47 154.79 28.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.823 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.423 HG21 ' CD2' ' A' ' 122' ' ' HIS . 91.3 m -155.15 140.9 18.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.07 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.9 t -127.61 156.18 39.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.14 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -153.52 167.43 13.59 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.495 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -79.19 45.54 1.96 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.534 2.156 . . . . 0.0 112.749 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 47.13 29.51 1.15 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.01 0.433 . . . . 0.0 111.159 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.2 p30 -85.72 -176.85 6.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.88 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 167.62 -165.51 38.72 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.597 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -140.0 156.04 70.6 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 120.664 0.268 . . . . 0.0 110.874 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -68.22 151.69 76.58 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.489 2.126 . . . . 0.0 112.256 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -86.63 -80.05 1.19 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.603 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.466 ' HB2' ' HD2' ' A' ' 52' ' ' PRO . 93.0 Cg_endo -77.35 -164.28 0.26 Allowed 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.586 2.191 . . . . 0.0 112.2 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.456 ' HB2' ' HD3' ' A' ' 52' ' ' PRO . 1.0 OUTLIER -72.54 -48.86 9.03 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.571 -179.48 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.466 ' HD2' ' HB2' ' A' ' 50' ' ' PRO . 37.1 Cg_exo -60.9 101.49 0.18 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.422 2.082 . . . . 0.0 112.152 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -85.09 140.71 37.04 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.862 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.74 62.53 6.47 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.675 2.25 . . . . 0.0 112.348 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -149.93 157.45 43.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.161 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.39 -21.85 25.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.045 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 70.33 -65.85 0.3 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.782 0.325 . . . . 0.0 110.834 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -133.97 134.12 42.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.892 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -151.55 -86.56 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.509 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.93 174.64 15.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.743 0.306 . . . . 0.0 111.182 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -163.08 106.95 1.05 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.077 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.43 ' N ' ' HD2' ' A' ' 63' ' ' PRO . 0.6 OUTLIER -64.37 -58.95 12.02 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.019 179.924 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' A' ' 62' ' ' GLU . 65.7 Cg_endo -75.42 169.36 22.59 Favored 'Trans proline' 0 N--CA 1.463 -0.279 0 C-N-CA 122.971 2.447 . . . . 0.0 112.297 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -139.28 -44.51 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.622 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -137.71 125.98 23.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.92 0.39 . . . . 0.0 111.135 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.22 154.85 42.66 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.104 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -69.07 110.37 2.4 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.585 2.19 . . . . 0.0 112.325 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -62.97 103.4 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.537 2.158 . . . . 0.0 112.268 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -146.3 21.57 1.36 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.099 0.475 . . . . 0.0 111.287 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.0 mp 62.14 145.78 0.08 OUTLIER Pre-proline 0 C--N 1.32 -0.714 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.903 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -56.22 -167.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.5 2.133 . . . . 0.0 112.185 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 64.76 71.35 0.46 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.44 0.638 . . . . 0.0 110.81 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 168.61 -35.44 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.621 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 7.4 tt -110.08 -34.9 6.27 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.798 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.3 -15.06 63.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.451 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.47 -29.59 20.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.896 0.379 . . . . 0.0 111.008 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -59.23 -26.3 64.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.083 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -94.28 42.39 1.09 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.871 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -150.48 30.67 0.67 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.857 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 23.7 t -124.28 -40.38 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.06 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.499 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.8 OUTLIER -54.69 -48.93 94.05 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.915 0.388 . . . . 0.0 111.279 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.499 ' CD ' ' N ' ' A' ' 81' ' ' SER . 2.9 Cg_exo -74.3 52.39 2.75 Favored 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 123.293 2.662 . . . . 0.0 112.34 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.415 ' CG ' ' O ' ' A' ' 82' ' ' PRO . 0.4 OUTLIER 174.61 38.67 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.899 0.381 . . . . 0.0 110.698 180.0 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.1 t80 179.64 127.27 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.734 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.4 mttt 60.77 172.74 0.1 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.898 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.5 p-10 -94.26 103.7 15.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.895 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.3 m -73.41 -168.41 0.53 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.887 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -144.82 92.87 2.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.036 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -171.78 143.83 7.75 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.529 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 89.63 -162.5 30.43 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.463 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.9 t -82.38 118.46 23.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.759 0.314 . . . . 0.0 110.834 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 18.3 m -138.63 111.46 7.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.928 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.1 p -91.6 150.49 3.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.048 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -178.1 -56.63 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.503 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 6.1 t-105 -125.83 38.89 4.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.816 0.341 . . . . 0.0 110.883 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 14.2 t70 60.88 31.98 20.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.925 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -83.27 155.51 66.64 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.856 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.91 111.07 2.74 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.634 2.223 . . . . 0.0 112.306 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -77.61 -27.7 5.98 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.504 2.136 . . . . 0.0 112.286 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -140.5 164.39 30.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.13 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 2.8 m -125.89 157.17 70.03 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.823 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -52.04 149.86 20.09 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.542 2.162 . . . . 0.0 112.222 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.6 mm? 60.89 109.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.861 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -82.53 147.75 28.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.928 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 22.8 mtp85 -80.88 139.02 36.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.859 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -172.71 59.08 0.24 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.834 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -69.21 -46.73 1.32 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.643 2.229 . . . . 0.0 112.311 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.8 t -92.32 167.66 11.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.917 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.1 m -90.25 138.51 27.19 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.869 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.95 162.04 32.45 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.523 2.148 . . . . 0.0 112.496 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.418 ' N ' ' HD3' ' A' ' 112' ' ' PRO . . . 57.12 62.97 5.75 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.919 -0.657 . . . . 0.0 112.707 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . 0.418 ' HD3' ' N ' ' A' ' 111' ' ' GLY . 17.0 Cg_exo -66.93 -162.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.669 2.246 . . . . 0.0 112.259 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -138.9 101.15 7.87 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.842 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.67 122.51 9.92 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.43 2.086 . . . . 0.0 112.222 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.8 93.13 7.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.887 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -152.96 -46.54 0.1 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.88 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 7.3 tp -111.43 96.86 6.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.954 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.1 p -81.59 -31.74 32.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.878 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.83 -168.27 1.58 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.832 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -132.5 165.83 23.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.17 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 12.3 mtmm -104.48 90.48 3.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.96 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.423 ' CD2' HG21 ' A' ' 40' ' ' THR . 12.6 m-70 -93.03 116.3 28.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.935 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 4.5 t -90.93 115.97 31.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.893 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 21.2 m -57.05 -28.01 62.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.259 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.3 mp 63.97 -166.94 0.22 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.809 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.1 tttt 63.14 33.44 14.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.815 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.3 ptt? 176.76 -35.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.79 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.6 -175.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.376 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.476 ' CE2' ' CB ' ' A' ' 147' ' ' CYS . 1.0 OUTLIER -162.07 113.96 1.69 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.75 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.489 HG12 ' N ' ' A' ' 173' ' ' GLN . 2.3 p -89.31 159.9 2.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.381 0.61 . . . . 0.0 111.414 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.471 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.4 OUTLIER -165.98 138.28 3.97 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.866 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.02 117.23 29.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.946 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.444 ' CB ' ' CZ ' ' A' ' 143' ' ' TYR . 0.0 OUTLIER -124.08 156.3 36.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.839 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 13.5 t -69.72 143.13 53.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.946 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.54 142.34 24.54 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.858 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -56.23 -26.38 60.83 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.524 2.15 . . . . 0.0 112.435 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 69.6 p -89.08 -37.27 15.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.111 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -107.35 119.49 50.64 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.075 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -69.56 -50.74 0.46 Allowed 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.361 2.041 . . . . 0.0 112.323 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.431 ' HB2' ' HD3' ' A' ' 141' ' ' PRO . 2.9 mt-10 -93.49 -50.0 0.27 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.196 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.431 ' HD3' ' HB2' ' A' ' 140' ' ' GLU . 34.8 Cg_exo -59.9 90.74 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.341 2.028 . . . . 0.0 112.223 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -76.16 128.65 35.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.838 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.444 ' CZ ' ' CB ' ' A' ' 133' ' ' ARG . 24.5 p90 -61.71 137.06 58.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.891 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.7 mt -92.17 105.57 17.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.419 ' HG3' ' CZ ' ' A' ' 156' ' ' PHE . 0.5 OUTLIER -100.29 115.31 29.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.938 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 28.1 mt -121.1 131.95 71.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.021 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . 0.476 ' CB ' ' CE2' ' A' ' 129' ' ' TYR . 0.8 OUTLIER -120.47 123.41 42.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.972 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -106.22 147.34 29.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.083 0.468 . . . . 0.0 111.175 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.47 30.38 2.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.303 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -112.68 43.65 1.62 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.072 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 122.39 23.84 2.29 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.106 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.412 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 5.9 mm-40 56.71 59.42 3.55 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 120.943 0.401 . . . . 0.0 110.957 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -89.03 149.59 23.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.855 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.22 89.1 1.41 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.996 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 4.7 m -87.12 122.35 38.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.315 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.419 ' CZ ' ' HG3' ' A' ' 145' ' ' GLU . 7.9 m-85 -107.16 97.99 7.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.604 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.4 mt -104.39 162.0 13.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.183 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.438 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -132.97 87.63 2.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.636 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -49.97 172.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.515 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.2 tttm -78.56 -67.13 0.77 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.984 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -98.07 179.27 4.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.927 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.88 -40.87 21.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.887 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.97 94.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.071 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 1.4 m -66.09 -48.04 72.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.575 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -64.54 -34.98 79.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.775 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.11 -45.52 56.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.305 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 53.8 p -63.63 -36.94 85.47 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . 0.512 ' O ' HG12 ' A' ' 172' ' ' ILE . 10.2 m95 -69.23 -57.08 5.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.463 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . 0.42 ' O ' HG12 ' A' ' 130' ' ' VAL . . . -49.5 -57.81 6.35 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.321 0.581 . . . . 0.0 110.715 179.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.42 -38.11 56.99 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.564 -0.743 . . . . 0.0 112.619 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.63 -40.59 76.46 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 120.675 -0.41 . . . . 0.0 111.04 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 168' ' ' TRP . 39.0 mm -60.94 -23.88 31.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 177.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.489 ' N ' HG12 ' A' ' 130' ' ' VAL . 2.2 tt0 -78.01 -37.53 46.89 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.494 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . 0.405 ' HA ' ' CG2' ' A' ' 178' ' ' THR . . . -60.38 -46.83 88.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.614 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 89.2 mm-40 -72.02 -34.2 68.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.188 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . . . . . . . . . 41.9 mt -70.63 -29.24 37.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.688 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 145.63 -43.2 0.93 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.761 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' THR . . . . . 0.405 ' CG2' ' HA ' ' A' ' 174' ' ' ALA . 11.9 t . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.236 -0.887 . . . . 0.0 111.522 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.79 0.329 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -165.06 -60.36 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.985 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 121.94 -58.15 0.6 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.53 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -156.96 148.02 21.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.829 0.347 . . . . 0.0 110.962 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -176.05 142.71 0.52 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.885 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -118.01 116.96 35.7 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.096 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.85 154.13 67.75 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.417 2.078 . . . . 0.0 112.367 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -80.28 150.93 29.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.832 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 28.0 p -152.61 162.86 40.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.915 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 172.68 133.61 1.68 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.431 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 17.4 mt -63.09 120.1 10.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.783 0.325 . . . . 0.0 110.991 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -127.68 170.12 13.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.416 ' HB3' ' CZ3' ' A' ' 27' ' ' TRP . 3.0 tt0 -103.36 166.55 10.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.976 0.417 . . . . 0.0 111.122 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.402 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 26.1 tp -148.45 126.71 12.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.523 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.466 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 4.4 ptt180 -69.42 -166.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.909 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.6 t -170.89 70.63 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.83 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 158.39 133.08 1.49 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.524 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -150.69 128.63 11.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.807 0.337 . . . . 0.0 111.098 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -172.36 -84.85 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.413 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.45 33.12 4.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.734 0.302 . . . . 0.0 110.882 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.5 -122.28 6.04 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.513 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -78.26 139.59 38.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.722 0.296 . . . . 0.0 111.097 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 143.83 60.17 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.493 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.68 87.14 1.86 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.518 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -123.86 120.34 32.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.822 0.344 . . . . 0.0 110.837 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -108.36 68.27 0.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.839 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.466 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 31.0 m95 -58.92 164.24 3.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.967 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -153.86 173.62 15.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.937 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -102.17 121.09 41.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.098 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 26.9 m -139.75 121.96 16.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.067 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.01 136.17 50.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.632 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 mp -102.57 159.76 15.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 t -142.11 92.06 2.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.43 HD13 ' CE3' ' A' ' 168' ' ' TRP . 0.6 OUTLIER -79.39 97.38 6.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.858 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -101.01 137.49 39.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.062 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -56.82 -23.09 41.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.115 0.483 . . . . 0.0 111.229 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -86.6 -32.28 20.71 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.778 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -178.15 175.27 1.25 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.175 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.18 131.36 50.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.623 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 70.4 m -131.1 128.41 40.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.942 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.9 t -114.93 159.13 14.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.136 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.6 t -155.64 153.16 25.78 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.552 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.33 45.13 1.15 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.548 2.165 . . . . 0.0 112.822 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 46.44 29.87 0.97 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.916 0.388 . . . . 0.0 111.345 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -58.74 128.09 35.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.895 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 174.02 -165.17 36.76 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.588 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -143.59 80.31 13.04 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.683 0.278 . . . . 0.0 110.878 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.18 142.07 45.14 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.58 2.187 . . . . 0.0 112.296 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 163.73 94.07 0.1 OUTLIER Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.427 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -51.2 -47.94 23.47 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.583 2.188 . . . . 0.0 112.394 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -126.1 148.68 64.08 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.807 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.55 124.06 14.31 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.557 2.171 . . . . 0.0 112.212 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -146.93 77.07 11.23 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.878 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.76 174.74 0.1 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.582 2.188 . . . . 0.0 112.235 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.92 135.0 51.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.071 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.28 98.37 7.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.857 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.79 160.52 31.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 60.52 160.14 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.907 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 127.78 -69.26 0.53 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.486 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -119.33 96.05 5.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.887 0.375 . . . . 0.0 111.06 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 60.01 172.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.062 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -86.66 127.27 61.03 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.874 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.16 165.24 33.2 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.397 2.064 . . . . 0.0 112.299 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -151.01 -108.77 0.42 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.395 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -118.36 179.2 4.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.912 0.387 . . . . 0.0 111.082 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -126.41 97.68 33.62 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.045 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -67.62 139.47 48.72 Favored 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 122.382 2.055 . . . . 0.0 112.21 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.09 60.49 5.52 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.478 2.118 . . . . 0.0 112.375 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.68 138.75 31.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.868 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.5 mt -92.11 132.86 31.39 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.794 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.03 -173.76 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.319 2.013 . . . . 0.0 112.224 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 64.51 71.0 0.48 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.387 0.613 . . . . 0.0 110.724 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 167.22 -35.94 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.387 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.1 tt -106.75 -27.92 10.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.776 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.4 -13.85 53.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.366 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.0 mt -95.49 27.3 3.45 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.828 0.347 . . . . 0.0 111.133 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -153.84 26.21 0.49 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.888 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.4 ptm85 -131.24 -39.53 1.17 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.091 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.418 ' HG3' ' CE1' ' A' ' 84' ' ' PHE . 22.0 pt-20 -95.43 30.83 2.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.052 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.7 t -117.43 -30.11 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.201 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.484 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -55.04 -49.13 93.96 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.29 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.484 ' CD ' ' N ' ' A' ' 81' ' ' SER . 53.8 Cg_endo -92.4 -141.11 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 123.597 2.864 . . . . 0.0 111.649 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -90.72 148.62 22.47 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.003 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.418 ' CE1' ' HG3' ' A' ' 79' ' ' GLU . 0.1 OUTLIER -95.94 86.06 4.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.805 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.17 54.36 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.863 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -176.25 117.4 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.921 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -119.56 31.57 6.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.953 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 59.84 108.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.159 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -97.42 29.02 11.59 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.404 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 93.71 46.52 3.16 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.816 -0.706 . . . . 0.0 112.498 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 3.6 t -148.51 156.51 42.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.855 0.36 . . . . 0.0 110.873 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 6.0 t -110.01 144.13 39.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.817 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 9.8 p -62.44 147.2 11.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.058 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 147.48 -45.14 0.77 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.457 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 60.37 96.79 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.771 0.32 . . . . 0.0 110.846 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -164.47 68.52 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.804 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.76 112.54 4.58 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.895 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo -51.05 161.56 1.47 Allowed 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.457 2.105 . . . . 0.0 112.334 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -73.85 -27.8 12.0 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.653 2.235 . . . . 0.0 112.316 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -128.16 100.73 5.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.054 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.82 100.89 0.27 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.922 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -68.61 64.54 1.21 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.358 2.038 . . . . 0.0 112.319 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 12.6 mt -105.88 141.18 37.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.895 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -127.39 111.15 13.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.947 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.82 160.55 38.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.8 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -89.59 140.36 28.18 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.848 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -75.27 -44.87 0.29 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.462 2.108 . . . . 0.0 112.393 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 30.9 t -83.11 132.09 35.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.45 ' N ' ' CD ' ' A' ' 110' ' ' PRO . 0.5 OUTLIER -83.22 -52.19 0.63 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.064 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.45 ' CD ' ' N ' ' A' ' 109' ' ' SER . 41.1 Cg_exo -55.61 162.42 6.46 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.813 2.342 . . . . 0.0 112.218 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.458 ' N ' ' HD3' ' A' ' 112' ' ' PRO . . . -149.95 60.96 0.42 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.635 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . 0.458 ' HD3' ' N ' ' A' ' 111' ' ' GLY . 12.4 Cg_exo -69.89 -164.83 0.14 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.679 2.252 . . . . 0.0 112.086 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 18.0 mp0 -116.76 143.81 32.14 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.768 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_exo -51.71 126.8 20.75 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.517 2.145 . . . . 0.0 112.345 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.8 mtp-105 -148.13 105.86 3.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.889 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -166.88 -51.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.89 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 23.1 tp -84.27 -64.12 1.22 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.84 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 58.04 30.09 18.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.962 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -165.43 119.89 1.26 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.833 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -83.0 166.86 18.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.136 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 17.7 mttm -117.76 103.77 10.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.92 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 8.1 m170 -101.56 101.99 12.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.042 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.9 t -90.03 139.43 17.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.868 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.2 p -54.83 -36.98 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.22 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 6.4 tp 62.71 30.71 16.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.003 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -143.85 36.66 1.29 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.41 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 177.27 -30.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.8 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.403 ' HB2' ' HA ' ' A' ' 148' ' ' ALA . . . -55.3 -166.64 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.23 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -165.89 122.39 1.36 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.656 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.476 HG13 ' N ' ' A' ' 173' ' ' GLN . 2.8 p -99.28 159.97 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.399 0.619 . . . . 0.0 111.657 -179.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 4.5 p -160.81 154.58 22.42 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.562 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.66 100.14 5.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.905 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.08 172.85 7.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.849 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 26.3 p -79.29 179.96 7.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.973 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.445 ' CG2' ' CE1' ' A' ' 143' ' ' TYR . 1.7 m -143.01 101.4 5.31 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -49.69 -26.87 13.88 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.502 2.135 . . . . 0.0 112.471 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.6 p -80.44 -31.53 37.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.901 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -151.25 91.79 3.86 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.842 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.26 83.14 2.2 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.459 2.106 . . . . 0.0 112.359 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.431 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.1 OUTLIER -177.2 -62.71 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.962 179.828 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.431 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 41.0 Cg_endo -67.07 -21.62 48.86 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.493 2.129 . . . . 0.0 112.401 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 61.09 156.18 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.983 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.445 ' CE1' ' CG2' ' A' ' 135' ' ' THR . 1.4 m-30 -106.18 112.48 25.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.922 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.21 153.21 27.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.834 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.41 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.1 tt0 -158.77 137.78 11.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 4.5 mp -141.65 120.82 10.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.053 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 16.3 m -100.95 139.58 36.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.851 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . 0.403 ' HA ' ' HB2' ' A' ' 128' ' ' ALA . . . -106.7 149.08 27.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.425 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.73 30.3 2.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.215 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -121.73 48.49 1.69 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.071 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.58 18.81 3.93 Favored Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.123 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.424 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 3.3 mm-40 58.97 61.48 2.13 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.086 0.47 . . . . 0.0 111.005 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.5 165.54 15.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.552 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.96 96.56 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.219 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.8 m -91.85 127.09 44.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.266 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.41 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 0.2 OUTLIER -107.48 117.35 33.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.668 179.787 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -124.72 161.3 26.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.029 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.439 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -127.31 112.77 15.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.842 -179.903 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -71.05 172.92 8.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.094 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -80.77 -66.47 0.88 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.929 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -103.0 -178.36 3.64 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.886 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -75.84 -49.45 17.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.964 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -60.37 -36.69 78.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.151 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 66.3 m -67.62 -44.21 78.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.761 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.96 -37.9 85.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.809 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -73.68 -41.74 62.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.316 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 3.7 m -65.77 -32.73 74.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.924 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . 0.43 ' CE3' HD13 ' A' ' 34' ' ' LEU . 11.3 m95 -75.76 -54.88 6.25 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.57 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -57.44 -47.29 82.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.323 0.583 . . . . 0.0 110.407 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -60.46 -41.72 98.73 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.638 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.7 -40.19 73.0 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.855 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.448 HG23 ' CD1' ' A' ' 176' ' ' ILE . 17.3 mt -60.88 -24.39 32.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.476 ' N ' HG13 ' A' ' 130' ' ' VAL . 17.8 tt0 -80.61 -31.67 36.56 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.229 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -62.36 -48.83 78.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.241 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -67.89 -40.77 83.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.773 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . 0.448 ' CD1' HG23 ' A' ' 172' ' ' ILE . 81.9 mt -77.6 -4.77 6.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.414 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -83.51 20.18 12.17 Favored Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.896 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.805 179.939 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.907 0.384 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.2 p -96.24 153.92 17.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.857 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 80.26 97.91 0.33 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.492 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -108.09 30.25 6.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.854 0.359 . . . . 0.0 110.973 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 58.81 78.25 0.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.926 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -147.9 96.96 3.97 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.99 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -59.82 150.83 75.2 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.548 2.165 . . . . 0.0 112.237 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.6 ttt85 -93.49 129.62 39.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.488 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.6 p -137.59 140.77 41.17 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.929 0.395 . . . . 0.0 111.198 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.18 135.1 6.25 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.367 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.3 mt -58.64 108.17 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.936 0.398 . . . . 0.0 111.006 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.87 164.79 14.91 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.755 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -102.96 155.54 18.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.946 0.403 . . . . 0.0 111.019 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 5.8 tp -133.96 135.17 43.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.614 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.477 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 31.0 ttp180 -69.59 166.84 18.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.803 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.0 t -142.95 163.76 31.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.789 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -163.82 -53.94 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.534 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -84.27 170.66 13.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.811 0.339 . . . . 0.0 111.088 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.58 -97.07 2.11 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.418 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.6 m -135.29 -177.13 4.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.819 0.342 . . . . 0.0 110.958 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.75 -159.09 14.15 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.461 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -171.11 171.03 5.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.825 0.345 . . . . 0.0 111.071 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.68 -69.71 3.25 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.466 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -169.6 -98.65 0.12 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.517 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -97.63 154.09 17.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.779 0.323 . . . . 0.0 111.042 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.1 ttt180 -137.27 71.37 1.4 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.838 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.477 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 45.1 m95 -48.2 166.2 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.168 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -154.59 -172.42 4.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.945 0.403 . . . . 0.0 111.058 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -109.7 121.84 46.13 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.048 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 30.6 m -140.51 124.28 17.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.094 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tp -69.72 120.86 16.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.567 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.5 tp -89.08 116.35 27.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.017 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.58 89.36 4.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.676 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 tp -89.15 123.99 33.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.003 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -134.5 149.21 50.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.027 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.4 -16.87 50.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.46 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -92.32 -27.02 17.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.013 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -178.58 176.75 0.97 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.047 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.33 95.6 4.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.844 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.404 HG23 ' CD2' ' A' ' 122' ' ' HIS . 60.5 m -102.69 130.24 49.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.984 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 9.8 t -100.72 157.64 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.06 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.8 p -147.33 154.15 45.23 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.603 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.43 40.51 0.85 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.592 2.195 . . . . 0.0 112.779 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 54.79 27.01 8.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.191 0.52 . . . . 0.0 111.015 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.84 152.91 40.12 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.878 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.58 120.33 2.66 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.577 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.528 ' N ' ' CD ' ' A' ' 48' ' ' PRO . 1.3 mt-10 -81.74 -46.32 1.05 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 120.666 0.269 . . . . 0.0 111.357 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 47' ' ' GLU . 63.8 Cg_exo -50.93 144.43 27.52 Favored 'Trans proline' 0 C--O 1.233 0.237 0 C-N-CA 122.741 2.294 . . . . 0.0 112.388 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 70.12 150.94 0.58 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.499 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -68.44 179.82 2.78 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.536 2.157 . . . . 0.0 112.284 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -140.57 157.46 68.04 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.847 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.04 160.58 43.81 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.597 2.198 . . . . 0.0 112.224 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -56.88 108.98 1.4 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.998 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.87 -174.49 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.46 2.106 . . . . 0.0 112.35 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 62.92 144.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.193 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 60.01 -178.45 0.1 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.936 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.436 ' CD1' ' N ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -149.95 170.92 17.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.016 179.875 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -59.47 173.67 0.5 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.162 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -159.39 61.16 0.31 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.488 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.45 158.82 28.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.799 0.333 . . . . 0.0 111.138 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -117.82 49.2 1.26 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.019 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -135.55 114.31 11.26 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -51.75 -178.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.382 2.055 . . . . 0.0 112.329 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 173.09 -153.36 18.06 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.424 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -78.95 94.54 5.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.822 0.344 . . . . 0.0 111.164 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -127.5 88.36 53.92 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.033 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 161.01 47.59 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.535 2.157 . . . . 0.0 112.335 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.3 134.68 57.86 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.636 2.224 . . . . 0.0 112.312 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 62.51 144.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.972 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.419 ' N ' ' HD2' ' A' ' 71' ' ' PRO . 0.2 OUTLIER -72.77 -58.95 2.52 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.111 179.958 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.419 ' HD2' ' N ' ' A' ' 70' ' ' LEU . 69.8 Cg_endo -75.55 143.66 27.62 Favored 'Trans proline' 0 N--CA 1.465 -0.182 0 C-N-CA 122.876 2.384 . . . . 0.0 112.379 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 60.57 68.21 0.77 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.394 0.616 . . . . 0.0 110.696 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 163.62 -39.06 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.606 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 9.2 tt -90.32 -32.09 16.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.879 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.81 -41.78 82.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.926 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.5 tp -59.51 -56.08 26.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.98 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.9 48.21 1.33 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.977 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -84.25 -10.22 57.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.421 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -94.27 41.26 1.09 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.842 0.353 . . . . 0.0 111.015 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 23.7 t -143.04 -64.25 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 59.04 168.3 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -68.4 60.05 1.06 Allowed 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.863 2.375 . . . . 0.0 112.277 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -162.75 32.01 0.1 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.872 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -156.42 113.47 3.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.835 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -101.33 159.95 14.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.844 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -95.65 -31.9 13.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.901 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.6 m -66.31 -45.05 81.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -96.71 38.29 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.193 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.45 122.94 19.1 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.524 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -153.72 -137.06 2.4 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.478 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.0 t -145.25 146.93 31.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.73 0.3 . . . . 0.0 110.909 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.6 m -130.02 133.0 46.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.886 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.1 p -61.89 118.66 4.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.052 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -166.73 84.55 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.525 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -131.95 39.13 3.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.871 0.367 . . . . 0.0 110.859 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -151.82 62.42 0.86 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.804 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 15.7 m -145.74 158.19 50.07 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.886 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -67.28 162.81 36.97 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.492 2.128 . . . . 0.0 112.321 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.45 -21.04 35.5 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.538 2.159 . . . . 0.0 112.442 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -104.98 160.38 15.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.192 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.9 156.14 65.61 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.761 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -69.02 171.19 14.08 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.535 2.157 . . . . 0.0 112.326 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 mp -61.44 121.86 13.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.927 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -110.05 -30.11 7.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.012 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -74.45 -75.47 0.16 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.927 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -177.91 148.39 0.66 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.968 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.73 -25.9 19.95 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.591 2.194 . . . . 0.0 112.35 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m 63.59 161.6 0.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.947 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.3 m -90.41 111.82 49.42 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.906 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.33 125.37 11.77 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.429 2.086 . . . . 0.0 112.309 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -151.78 -96.46 0.14 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.469 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.72 134.84 60.4 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.458 2.105 . . . . 0.0 112.233 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -81.3 110.35 18.1 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.812 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.63 136.95 31.88 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.439 2.093 . . . . 0.0 112.348 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 50.9 mtt180 -87.01 56.14 3.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.849 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -126.4 -63.1 1.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.908 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -147.81 106.93 3.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.027 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.1 m -123.21 -41.37 2.32 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.893 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -117.75 23.26 11.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.073 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . 69.42 157.75 0.16 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.036 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 12.6 mttm -106.81 81.08 1.52 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.008 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.404 ' CD2' HG23 ' A' ' 40' ' ' THR . 15.9 m-70 -72.24 93.63 1.49 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.873 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.5 t -88.2 111.21 22.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.207 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.29 129.06 38.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.844 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.3 mp -88.9 -170.02 2.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.031 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.29 38.5 16.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.773 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.88 -38.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.858 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.73 -169.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.205 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -162.19 115.04 1.74 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.471 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.494 HG11 ' N ' ' A' ' 173' ' ' GLN . 7.1 p -91.0 162.42 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.479 0.657 . . . . 0.0 111.793 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.455 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.1 m -165.35 141.41 5.39 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.492 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 19.7 ptt85 -107.76 115.31 29.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.953 0.406 . . . . 0.0 111.043 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.466 ' O ' ' N ' ' A' ' 143' ' ' TYR . 2.8 mtp180 -118.64 -173.8 2.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.595 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . 0.408 ' HB2' ' HD2' ' A' ' 139' ' ' PRO . 0.8 OUTLIER -139.4 -178.85 5.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.995 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.426 ' CG2' ' HD3' ' A' ' 136' ' ' PRO . 0.2 OUTLIER -165.0 -58.35 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.341 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.43 179.944 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . 0.426 ' HD3' ' CG2' ' A' ' 135' ' ' THR . 88.6 Cg_exo -46.35 -66.79 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.425 2.084 . . . . 0.0 112.765 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.2 p -108.92 -9.06 15.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.804 0.335 . . . . 0.0 111.01 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.545 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 13.5 m-20 65.43 38.68 0.23 Allowed Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.139 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.545 ' CD ' ' N ' ' A' ' 138' ' ' ASP . 74.0 Cg_endo -76.97 -50.09 0.1 Allowed 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 121.903 1.735 . . . . 0.0 111.864 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.54 ' CB ' ' HD3' ' A' ' 141' ' ' PRO . 1.1 mt-10 163.76 -63.47 0.0 OUTLIER Pre-proline 0 CA--C 1.53 0.205 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.472 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.54 ' HD3' ' CB ' ' A' ' 140' ' ' GLU . 49.6 Cg_endo -90.38 85.59 0.39 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.824 2.349 . . . . 0.0 112.604 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -159.84 27.67 0.18 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.346 . . . . 0.0 111.473 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.466 ' N ' ' O ' ' A' ' 133' ' ' ARG . 19.3 t80 -177.5 83.2 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.946 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.11 108.77 12.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.712 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -111.88 144.13 41.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 19.6 mt -139.1 126.03 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.066 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.8 p -111.65 117.83 33.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -98.61 146.34 25.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.236 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.05 31.68 2.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.237 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -115.33 44.62 1.8 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.33 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.56 24.21 2.42 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.484 -179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.33 60.09 2.76 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.985 0.421 . . . . 0.0 110.969 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.7 151.98 20.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.739 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -155.05 90.0 1.25 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.247 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 10.4 m -89.21 127.58 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.075 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.78 117.23 31.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.918 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.1 mp -126.62 168.69 13.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.417 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 1.7 ttp85 -142.32 118.2 10.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.954 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -78.05 172.67 13.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.037 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.99 -31.79 12.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -106.41 140.17 39.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.926 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -66.37 -42.85 87.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.085 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.88 -46.11 75.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.067 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.47 -49.53 77.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.62 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -58.25 -38.93 77.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.139 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.6 ttt-85 -69.7 -47.79 61.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.532 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.64 -30.81 71.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.022 0.439 . . . . 0.0 110.249 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -72.13 -48.95 39.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.972 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -57.87 -54.55 45.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.283 0.564 . . . . 0.0 110.545 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.64 -36.96 80.98 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.642 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -72.84 -39.57 66.46 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 120.966 0.413 . . . . 0.0 110.615 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.447 HG22 ' CD1' ' A' ' 176' ' ' ILE . 11.9 mt -61.94 -22.74 29.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.494 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.7 OUTLIER -77.96 -44.77 25.79 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.532 179.644 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . 0.481 ' HA ' ' CG2' ' A' ' 178' ' ' THR . . . -64.82 -33.94 77.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.591 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.45 -29.84 41.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.981 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . 0.447 ' CD1' HG22 ' A' ' 172' ' ' ILE . 6.1 mt -68.04 -28.93 42.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.53 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 112.73 34.72 1.82 Allowed Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.685 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' THR . . . . . 0.481 ' CG2' ' HA ' ' A' ' 174' ' ' ALA . 1.1 t . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.957 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.846 0.355 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.2 m -98.72 124.38 43.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.848 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.59 169.79 17.53 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.472 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.1 ttt-85 -127.53 104.98 8.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.851 0.357 . . . . 0.0 110.775 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.25 143.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.844 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.79 140.47 37.79 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.145 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.06 165.79 25.19 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.606 2.204 . . . . 0.0 112.278 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.7 153.5 22.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.683 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 28.6 p -140.35 161.37 37.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.06 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -161.31 126.49 1.59 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.414 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.9 mt -60.32 110.46 1.25 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.744 0.307 . . . . 0.0 110.936 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -121.45 132.54 54.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.87 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.37 149.6 47.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.818 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 58.0 tp -125.51 139.69 53.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.772 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.465 ' HA ' ' CD2' ' A' ' 27' ' ' TRP . 6.1 ttm180 -69.41 -178.06 1.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.445 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -168.52 -42.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.881 0.372 . . . . 0.0 110.993 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -78.87 145.12 28.31 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.624 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -110.02 105.49 14.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.767 0.318 . . . . 0.0 110.944 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.79 170.67 31.25 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.592 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 97.0 p -133.73 99.72 4.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.938 0.399 . . . . 0.0 110.911 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.04 -79.89 0.28 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.483 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -153.28 146.07 24.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.835 0.35 . . . . 0.0 111.108 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.04 -30.93 0.21 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.52 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 136.28 77.04 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.531 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -79.83 134.4 36.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.77 0.319 . . . . 0.0 110.92 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 39.2 mtp85 -100.35 139.74 35.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.812 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.465 ' CD2' ' HA ' ' A' ' 15' ' ' ARG . 28.0 m95 -149.15 117.61 6.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.86 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -102.11 -173.35 2.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.972 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.15 128.03 56.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.897 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.5 m -143.62 122.95 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.172 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tp -69.82 137.01 51.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.576 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 mp -106.81 109.92 21.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.14 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 m -85.14 88.17 7.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.604 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 tp -79.76 131.36 35.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.191 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.59 145.51 38.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.913 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.46 -15.15 48.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.447 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -96.29 -24.02 16.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.046 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -177.42 -178.68 0.78 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 0.0 111.153 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 30.4 tp -128.32 102.88 6.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.722 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 58.5 m -102.91 136.39 42.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.031 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.7 t -109.25 159.33 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.101 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.9 t -160.08 149.29 14.1 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.495 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.17 46.92 1.66 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.622 2.215 . . . . 0.0 112.907 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 46.95 29.41 1.03 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.972 0.415 . . . . 0.0 111.244 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -171.44 104.4 0.21 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.025 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -97.3 113.47 4.72 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.348 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -135.77 96.93 12.95 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.639 0.257 . . . . 0.0 110.914 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.0 -167.46 0.17 Allowed 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.39 2.06 . . . . 0.0 112.129 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -152.82 72.18 0.27 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.602 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.06 94.58 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.538 2.159 . . . . 0.0 112.258 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 60.92 80.31 0.26 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.827 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -77.69 175.73 10.88 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.585 2.19 . . . . 0.0 112.485 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -90.54 157.01 44.96 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.781 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.01 101.38 0.8 Allowed 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.557 2.171 . . . . 0.0 112.281 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.13 107.18 2.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.04 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 61.22 -171.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.814 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.8 mp -90.85 -71.17 0.64 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.872 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 16.8 m120 58.87 90.52 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.961 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -123.73 42.24 1.61 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.483 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -170.57 158.95 6.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.811 0.339 . . . . 0.0 111.098 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 61.45 153.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.013 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -58.51 109.71 2.05 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.035 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.15 142.99 39.03 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.454 2.103 . . . . 0.0 112.321 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -159.35 -161.63 11.38 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.471 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -136.33 68.46 1.44 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.823 0.344 . . . . 0.0 111.046 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -89.64 144.45 31.91 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.012 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -73.83 110.85 3.16 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.548 2.165 . . . . 0.0 112.483 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -76.5 167.85 24.84 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.5 2.133 . . . . 0.0 112.278 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -78.92 152.38 31.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.955 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.441 ' HB2' ' HD3' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -156.01 -63.54 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.075 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.441 ' HD3' ' HB2' ' A' ' 70' ' ' LEU . 21.6 Cg_endo -61.95 -166.73 0.05 OUTLIER 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.693 2.262 . . . . 0.0 112.152 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 65.85 71.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.36 0.6 . . . . 0.0 110.725 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 168.12 -41.03 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.891 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -112.58 -32.89 6.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.195 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.419 ' CD1' ' N ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -61.33 -16.98 51.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.401 -179.723 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.419 ' N ' ' CD1' ' A' ' 75' ' ' LEU . 0.1 OUTLIER -90.24 3.05 54.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.262 -179.968 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -140.94 38.57 1.79 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.829 0.347 . . . . 0.0 110.968 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -88.51 -57.11 3.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.986 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -92.65 47.12 1.27 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.916 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 4.8 t -128.85 -57.0 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.866 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.448 ' CB ' ' HD2' ' A' ' 82' ' ' PRO . 0.3 OUTLIER -96.22 174.1 3.67 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.615 179.914 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.448 ' HD2' ' CB ' ' A' ' 81' ' ' SER . 63.2 Cg_endo -74.22 59.72 4.63 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.38 2.054 . . . . 0.0 112.156 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.9 t80 71.9 77.81 0.16 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.825 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -76.02 122.91 24.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.909 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -151.83 159.18 43.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -56.87 156.48 6.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.997 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -99.61 160.87 13.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.958 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 59.86 82.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.095 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 173.3 133.61 1.7 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.508 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 109.34 -99.89 1.3 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.522 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.7 t -118.4 -40.86 2.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.715 0.293 . . . . 0.0 110.886 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 61.04 159.16 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.857 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.2 p -85.6 136.53 22.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.106 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 140.65 80.53 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.509 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 6.6 m0 -113.76 34.29 4.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.874 0.369 . . . . 0.0 110.915 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -110.71 40.71 1.94 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.939 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.1 t 62.83 89.3 0.11 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.928 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.46 128.63 16.59 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.653 2.235 . . . . 0.0 112.169 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.24 -27.97 86.43 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.362 2.041 . . . . 0.0 112.121 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.46 175.22 5.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.175 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.4 t -149.18 88.65 5.03 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.885 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -51.26 148.22 19.26 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.637 2.225 . . . . 0.0 112.395 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 pp -166.81 33.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.87 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -72.58 124.49 25.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.28 135.27 45.23 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.832 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -103.44 92.21 3.84 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.816 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -68.18 66.73 1.01 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.418 2.079 . . . . 0.0 112.231 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.1 m -125.52 73.99 1.36 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.869 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.8 t 60.7 79.47 0.28 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.871 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.13 138.23 33.09 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.572 2.181 . . . . 0.0 112.232 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.13 -178.28 19.35 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.457 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -53.83 -171.54 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.649 2.232 . . . . 0.0 112.313 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -130.78 118.06 17.59 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.934 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.37 -170.81 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.354 2.036 . . . . 0.0 112.29 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 -141.53 -177.69 5.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.952 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.3 p-10 -59.54 -50.42 73.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.965 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 20.7 tp -90.75 -68.78 0.77 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.924 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 5.9 t 50.69 27.01 2.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.203 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -161.69 118.25 2.14 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.844 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.22 140.07 58.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.023 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -101.33 88.88 3.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.054 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -76.69 109.01 10.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.932 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.5 t -109.89 150.84 12.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.102 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 87.1 p -87.48 157.24 19.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.906 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.5 tp -120.67 31.75 6.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.923 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -133.39 38.38 3.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.707 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.4 mtt 177.6 -34.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.874 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.0 -171.53 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.988 0.423 . . . . 0.0 111.31 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -168.44 116.56 0.7 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.434 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.467 ' CG2' ' N ' ' A' ' 131' ' ' SER . 1.9 p -88.04 158.47 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.314 0.578 . . . . 0.0 111.579 -179.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.467 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 93.6 p -168.48 159.2 10.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.756 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 16.8 ptt85 -132.89 126.59 32.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.042 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -148.54 172.7 14.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.804 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -120.8 -176.46 3.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.944 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.486 ' OG1' ' HD3' ' A' ' 136' ' ' PRO . 0.4 OUTLIER -138.69 -62.46 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.257 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . 0.486 ' HD3' ' OG1' ' A' ' 135' ' ' THR . 81.7 Cg_endo -83.95 -8.24 10.1 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.176 1.917 . . . . 0.0 112.578 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.2 p 70.88 32.97 2.28 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.992 0.425 . . . . 0.0 110.732 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.493 ' CB ' ' CD ' ' A' ' 139' ' ' PRO . 0.4 OUTLIER -111.57 -68.66 0.03 OUTLIER Pre-proline 0 CA--C 1.531 0.238 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.326 -179.832 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.493 ' CD ' ' CB ' ' A' ' 138' ' ' ASP . 18.5 Cg_endo -58.95 98.71 0.1 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.191 1.927 . . . . 0.0 112.408 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.453 ' N ' ' CD ' ' A' ' 141' ' ' PRO . 0.2 OUTLIER -48.37 -50.03 59.52 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.127 179.85 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 140' ' ' GLU . 72.0 Cg_exo -48.83 -24.41 7.04 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.582 2.188 . . . . 0.0 112.555 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 8.1 mtt85 65.31 153.37 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.906 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.41 ' CD2' ' HD3' ' A' ' 158' ' ' ARG . 58.3 m-85 -82.25 127.6 33.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.942 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.402 ' CD2' ' CB ' ' A' ' 169' ' ' ALA . 0.3 OUTLIER -84.96 112.67 20.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.71 179.888 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.416 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.8 tt0 -108.12 131.23 54.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.986 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 35.6 mt -132.32 110.98 17.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.189 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 30.7 p -91.66 155.36 18.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.908 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -132.89 145.83 51.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.105 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.54 30.51 1.98 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.289 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -119.41 47.04 1.77 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.171 0.51 . . . . 0.0 110.115 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.23 17.06 4.57 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.266 -179.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 61.11 63.95 1.18 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.049 0.452 . . . . 0.0 110.91 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -91.07 162.69 14.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.818 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.28 96.04 0.48 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.157 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 9.4 m -90.63 124.97 43.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.199 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.416 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 0.5 OUTLIER -105.96 87.13 2.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.807 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.2 mt -99.86 171.25 7.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.98 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.41 ' HD3' ' CD2' ' A' ' 143' ' ' TYR . 6.5 ttp85 -143.58 116.33 8.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -70.84 172.87 8.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.205 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.74 -31.38 13.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.009 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -110.89 157.52 19.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.868 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -73.83 -57.12 4.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.851 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -61.08 -32.45 72.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.075 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 2.9 m -64.62 -52.58 56.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.8 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.89 77.35 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.051 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -45.23 60.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.365 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 59.8 p -66.52 -32.4 73.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.1 179.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 7.1 m95 -72.56 -49.88 29.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.743 179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . 0.402 ' CB ' ' CD2' ' A' ' 144' ' ' LEU . . . -58.92 -47.33 85.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.314 0.578 . . . . 0.0 110.385 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -59.7 -40.89 97.13 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.525 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.91 -40.29 72.24 Favored 'General case' 0 CA--C 1.51 -0.592 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.894 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.423 HG22 ' CD1' ' A' ' 176' ' ' ILE . 10.9 mt -60.98 -24.51 33.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 177.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.437 ' N ' HG13 ' A' ' 130' ' ' VAL . 19.5 tt0 -85.3 -25.91 26.91 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.507 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.83 -42.49 73.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.196 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -76.01 -39.99 54.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.814 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . 0.423 ' CD1' HG22 ' A' ' 172' ' ' ILE . 67.4 mt -80.7 -9.46 12.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.362 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -86.2 26.1 6.49 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.449 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.6 t . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.171 -0.919 . . . . 0.0 111.011 179.951 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.836 0.351 . . . . 0.0 111.081 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.4 p -109.69 -178.12 3.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -87.17 -37.4 8.33 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.472 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.46 154.32 46.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.782 0.325 . . . . 0.0 110.926 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.2 158.94 15.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -125.88 84.06 61.67 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.027 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.13 142.16 45.59 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.623 2.215 . . . . 0.0 112.45 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -86.26 136.63 33.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.697 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 34.0 p -136.45 148.39 47.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.954 0.407 . . . . 0.0 111.35 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.26 162.36 30.15 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.194 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.3 mt -82.98 132.93 35.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.791 0.329 . . . . 0.0 110.989 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -146.87 145.52 29.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.738 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -79.84 158.33 26.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.104 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 12.6 tp -141.89 128.97 20.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.411 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.468 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 29.5 ttp180 -69.59 67.0 0.22 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.894 0.378 . . . . 0.0 110.904 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.04 169.25 1.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.901 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -177.48 137.28 3.38 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.511 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -163.79 143.63 8.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.859 0.361 . . . . 0.0 111.124 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 139.41 -145.52 16.72 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.477 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 p -123.07 139.93 53.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.811 0.339 . . . . 0.0 110.954 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.18 -135.06 12.0 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.454 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.06 -45.68 0.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.922 0.392 . . . . 0.0 111.172 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -87.49 84.69 1.52 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.471 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 177.94 62.7 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.514 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -87.3 152.77 22.0 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.873 0.368 . . . . 0.0 110.926 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.2 mtp180 -138.32 115.37 10.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.915 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.468 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 39.6 m95 -69.23 163.71 24.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.934 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -160.74 152.66 19.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.959 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.54 120.14 22.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.921 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 33.3 m -130.1 133.86 63.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.062 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 12.0 tp -74.7 143.34 44.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.758 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.33 137.03 49.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.957 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.56 94.4 4.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.799 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.424 ' HA ' ' CD2' ' A' ' 39' ' ' LEU . 7.6 tp -89.31 115.3 26.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.962 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -117.89 149.11 41.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.702 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.82 -15.54 31.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.31 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -95.29 -26.85 15.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.236 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 179.05 171.65 0.86 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.806 0.336 . . . . 0.0 111.302 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.424 ' CD2' ' HA ' ' A' ' 34' ' ' LEU . 3.2 tm? -106.25 115.42 30.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.709 179.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.8 m -116.72 123.38 47.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.15 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.9 t -103.81 159.58 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.894 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -167.34 166.47 8.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.783 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -64.52 148.26 90.54 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.577 2.185 . . . . 0.0 112.259 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -98.41 45.66 1.01 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.054 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -88.38 66.99 8.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.905 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 69.0 164.87 3.75 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.485 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -96.91 103.34 14.56 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.61 0.243 . . . . 0.0 110.967 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.0 121.5 7.92 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.442 2.095 . . . . 0.0 112.25 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 143.5 -68.86 0.43 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.519 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.5 54.32 4.97 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.695 2.263 . . . . 0.0 112.534 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 178.26 75.34 0.13 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.804 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -51.47 167.23 0.4 Allowed 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.633 2.222 . . . . 0.0 112.408 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.92 70.18 0.98 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.873 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -57.66 142.98 95.96 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.501 2.134 . . . . 0.0 112.191 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -162.47 123.73 2.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.165 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -114.32 143.37 44.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.806 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -165.41 38.25 0.06 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.931 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -117.46 104.99 11.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.884 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -160.86 30.93 0.35 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.617 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -124.14 122.65 38.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.844 0.354 . . . . 0.0 111.147 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.96 140.43 55.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.033 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.92 162.25 44.72 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.999 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -68.23 107.15 1.5 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.524 2.15 . . . . 0.0 112.316 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.36 70.36 0.29 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.571 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -92.32 76.09 5.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.87 0.366 . . . . 0.0 110.922 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.438 ' CB ' ' CD ' ' A' ' 67' ' ' PRO . . . -179.2 -61.76 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.242 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' A' ' 66' ' ' ALA . 43.2 Cg_endo -69.37 152.56 71.31 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.843 2.362 . . . . 0.0 112.277 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -73.71 150.91 45.7 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.661 2.241 . . . . 0.0 112.365 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -140.26 109.38 6.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.918 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.491 ' N ' ' CD ' ' A' ' 71' ' ' PRO . 1.3 mp -81.65 -46.54 1.06 Allowed Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.696 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 70' ' ' LEU . 90.9 Cg_endo -81.87 -168.2 0.58 Allowed 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.619 2.212 . . . . 0.0 112.505 -179.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 65.79 72.63 0.4 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.495 0.664 . . . . 0.0 110.528 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 178.88 -48.82 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.866 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 10.2 mp -88.37 -27.64 21.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.871 178.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.411 ' CD1' ' C ' ' A' ' 75' ' ' LEU . 0.1 OUTLIER -75.39 -34.62 61.1 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.223 179.479 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.73 51.84 2.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.981 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -115.08 30.38 7.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.02 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -78.46 -48.77 14.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.993 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -85.5 57.36 4.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.777 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.4 t -135.15 -46.81 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.191 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.485 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -80.4 -49.83 1.15 Allowed Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.15 -179.912 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 81' ' ' SER . 48.5 Cg_endo -93.37 -141.44 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.09 0 C-N-CA 123.684 2.923 . . . . 0.0 111.653 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.416 ' H ' ' HB2' ' A' ' 82' ' ' PRO . 0.5 OUTLIER -69.95 161.1 30.66 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.864 179.984 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -129.21 159.46 36.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.997 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 9.3 mttp -122.68 -41.09 2.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.004 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 64.38 173.34 0.19 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.933 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.8 p -139.29 -52.48 0.55 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.915 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -77.72 -36.32 51.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.068 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -98.92 -152.36 27.53 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.479 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 96.88 -44.19 1.95 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.462 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.9 t -144.68 154.16 42.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.833 0.349 . . . . 0.0 110.807 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.48 138.55 36.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.92 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.3 p -80.88 129.65 37.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.082 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 170.82 93.74 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.508 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 60.29 80.08 0.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.752 0.31 . . . . 0.0 110.876 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -179.64 75.46 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.74 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 86.7 p -67.47 135.51 93.03 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.783 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.93 112.44 3.5 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.509 2.139 . . . . 0.0 112.323 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -56.07 -27.44 64.73 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.401 2.067 . . . . 0.0 112.282 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.15 -174.25 4.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.1 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -157.57 165.06 19.52 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.902 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.79 -179.35 1.27 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.525 2.15 . . . . 0.0 112.251 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 12.7 mt 61.29 155.05 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.883 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -129.28 -45.47 1.23 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.872 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.71 36.0 16.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.899 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.22 130.91 21.43 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.873 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.19 107.28 0.19 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.431 2.088 . . . . 0.0 112.232 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.2 m -88.18 -46.67 9.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.966 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.2 m 61.08 155.75 0.11 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.803 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -66.84 144.85 72.66 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.533 2.155 . . . . 0.0 112.217 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -179.69 -80.41 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.537 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.78 159.9 4.51 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.532 2.155 . . . . 0.0 112.272 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.8 119.82 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.904 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.75 166.2 0.92 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.371 2.048 . . . . 0.0 112.245 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 69.8 mtt85 -90.21 154.2 19.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.953 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -92.16 -51.36 5.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.875 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.3 87.16 2.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.916 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.0 m -95.28 -33.08 12.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.837 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -97.16 148.52 22.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.93 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.41 ' HB2' ' CD2' ' A' ' 122' ' ' HIS . . . -96.75 166.46 11.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.106 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -105.52 92.55 4.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.834 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.41 ' CD2' ' HB2' ' A' ' 120' ' ' ALA . 7.3 m-70 -93.77 109.49 21.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.198 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -116.55 121.83 68.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.762 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 10.6 t -56.57 140.09 47.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.826 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.411 ' CD2' ' HB3' ' A' ' 175' ' ' GLN . 1.9 mp -97.39 31.11 2.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.981 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 mtmm -133.65 32.18 3.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.531 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.55 -36.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.83 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.94 -172.34 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.172 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -168.77 120.65 0.78 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.843 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.469 HG12 ' N ' ' A' ' 173' ' ' GLN . 2.0 p -94.38 159.12 2.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.196 0.522 . . . . 0.0 111.123 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.468 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 13.6 t -164.46 155.11 14.85 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.846 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 21.2 ttp180 -121.52 84.04 2.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.642 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.02 163.36 26.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.899 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 1.3 t -110.49 140.18 45.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.895 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.81 164.28 47.48 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.773 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.07 -15.49 48.79 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.57 2.18 . . . . 0.0 112.48 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 43.9 p -96.68 -31.85 12.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.846 0.355 . . . . 0.0 110.943 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 60.14 65.76 2.2 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.887 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -63.24 -66.32 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.619 2.213 . . . . 0.0 112.346 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.417 ' N ' ' HD2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER 179.18 -61.09 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.998 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 140' ' ' GLU . 39.5 Cg_endo -66.81 -10.44 28.27 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.577 2.185 . . . . 0.0 112.688 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? 66.1 -173.94 0.18 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.796 0.331 . . . . 0.0 111.028 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -108.33 118.21 36.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.056 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -96.79 119.61 35.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.695 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.423 ' HG3' ' CE1' ' A' ' 156' ' ' PHE . 9.0 tt0 -125.81 138.22 53.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.066 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 14.2 mt -134.95 112.8 15.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.073 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 18.5 m -88.48 162.07 16.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.03 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -144.09 146.51 32.86 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.171 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.03 30.24 2.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.337 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.22 45.47 1.76 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.131 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 117.05 23.01 4.03 Favored Glycine 0 N--CA 1.449 -0.459 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.14 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 58.78 61.93 2.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 121.096 0.474 . . . . 0.0 110.84 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -88.66 161.95 16.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.883 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -168.38 89.82 0.26 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.144 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 30.2 m -77.5 132.89 31.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.127 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.423 ' CE1' ' HG3' ' A' ' 145' ' ' GLU . 68.0 m-85 -111.03 92.04 3.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.647 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.8 mt -104.04 160.19 15.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.19 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.456 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 2.9 ttt180 -133.38 97.17 3.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.828 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -54.34 171.28 0.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.247 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.85 -31.05 11.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.841 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -108.36 171.53 7.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.861 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.27 -55.65 3.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.967 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.41 -28.17 68.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.206 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -52.27 37.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.7 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.47 -37.43 83.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.949 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -73.19 -44.04 60.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.311 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 24.8 t -66.42 -33.24 75.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.874 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . 0.417 ' O ' HG12 ' A' ' 172' ' ' ILE . 11.5 m95 -72.5 -52.49 15.49 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.75 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -56.24 -45.87 79.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.291 0.567 . . . . 0.0 110.467 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.9 -44.54 96.01 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.527 -0.761 . . . . 0.0 112.734 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.09 -40.81 82.57 Favored 'General case' 0 CA--C 1.51 -0.571 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.176 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.417 HG12 ' O ' ' A' ' 168' ' ' TRP . 20.8 mm -60.4 -24.91 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.469 ' N ' HG12 ' A' ' 130' ' ' VAL . 30.8 tt0 -83.63 -26.15 30.18 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.571 179.416 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.66 -49.31 63.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.21 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . 0.411 ' HB3' ' CD2' ' A' ' 125' ' ' LEU . 1.9 mp0 -69.65 -41.26 75.82 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.787 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . 0.413 ' CD1' HG23 ' A' ' 172' ' ' ILE . 67.5 mt -80.05 -3.03 5.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.378 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -87.0 25.3 7.78 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.643 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.3 t . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.362 -0.828 . . . . 0.0 110.95 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.813 0.34 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m 60.76 177.13 0.1 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.971 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 148.44 -110.18 0.48 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.459 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.05 40.64 14.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.837 0.351 . . . . 0.0 110.932 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.3 mmt180 -142.59 103.32 4.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.858 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -132.13 90.71 34.13 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.149 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.55 156.42 63.94 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.598 2.199 . . . . 0.0 112.351 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.44 146.19 36.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.786 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 58.8 p -140.44 152.95 46.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.095 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -158.63 123.9 1.31 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.328 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 18.4 mt -64.28 100.73 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.875 0.369 . . . . 0.0 110.926 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.61 170.03 8.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.895 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.88 155.97 19.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.979 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 13.2 tp -134.37 127.8 32.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.638 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.436 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.7 OUTLIER -69.35 175.2 4.12 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.852 -179.539 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.5 t -166.79 98.14 0.55 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.95 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -150.68 66.16 0.36 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.515 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.21 179.99 3.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.843 0.354 . . . . 0.0 111.101 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.05 53.74 3.61 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.503 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.76 -55.8 3.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.854 0.359 . . . . 0.0 110.86 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 174.07 -48.81 0.15 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.461 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -99.16 89.56 4.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.799 0.333 . . . . 0.0 111.137 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -104.29 82.02 0.35 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.465 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -122.24 36.34 3.21 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.518 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 60.83 88.24 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.874 0.369 . . . . 0.0 110.906 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.1 63.03 0.75 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.788 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.463 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 46.6 m95 -58.7 160.28 5.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.962 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -147.39 152.61 38.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.018 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -80.63 121.32 25.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.041 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 31.9 m -134.52 137.82 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.135 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tp -86.16 127.8 34.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.616 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.16 103.44 14.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.015 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 m -82.24 78.57 8.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.657 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.424 HD21 ' CZ3' ' A' ' 168' ' ' TRP . 3.6 tp -74.48 93.29 2.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.17 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.46 147.8 22.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.916 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.2 -14.76 52.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.512 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.41 -17.33 14.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.237 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -174.23 173.71 3.02 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.78 0.324 . . . . 0.0 111.128 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.37 104.63 9.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.895 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.444 ' CG2' ' CD2' ' A' ' 122' ' ' HIS . 21.3 m -101.45 155.03 18.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.041 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.2 t -138.78 159.11 30.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.147 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.19 158.33 13.92 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.542 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -73.85 42.02 0.68 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.768 2.312 . . . . 0.0 112.78 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 46.05 29.83 0.84 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.032 0.444 . . . . 0.0 111.302 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -84.78 149.52 25.69 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.911 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -85.71 67.57 3.55 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.415 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -80.58 131.78 60.23 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.574 0.226 . . . . 0.0 110.765 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -53.41 144.07 51.88 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.438 2.092 . . . . 0.0 112.26 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -99.16 -74.27 1.13 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.49 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.83 113.03 3.41 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.64 2.227 . . . . 0.0 112.336 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 60.84 83.3 0.21 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.048 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.79 108.37 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.522 2.148 . . . . 0.0 112.284 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.51 143.67 97.83 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.921 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -73.91 150.36 43.75 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.531 2.154 . . . . 0.0 112.325 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 59.27 -169.11 0.14 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.2 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -157.49 53.24 0.48 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.968 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.1 151.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.901 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 34.5 p30 -129.12 62.88 1.5 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.872 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 136.98 141.42 4.25 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.524 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -144.17 177.65 8.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.814 0.34 . . . . 0.0 111.121 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -150.46 145.8 26.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.124 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -136.88 154.42 76.22 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.853 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.48 113.52 2.52 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.507 2.138 . . . . 0.0 112.267 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.19 -109.03 2.74 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.473 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -160.54 118.55 2.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.812 0.339 . . . . 0.0 111.083 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.57 159.4 84.69 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.026 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.21 159.04 4.54 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.531 2.154 . . . . 0.0 112.351 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.01 179.85 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.61 2.207 . . . . 0.0 112.25 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -86.22 134.8 33.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.856 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.2 mp -70.57 168.54 19.02 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.766 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -56.39 -165.02 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.537 2.158 . . . . 0.0 112.269 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 64.94 70.99 0.46 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.3 0.571 . . . . 0.0 110.72 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 167.82 -46.26 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.735 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 7.8 mp -93.67 -34.64 13.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.941 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.31 -15.7 60.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.444 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.21 -35.11 14.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.825 0.345 . . . . 0.0 110.869 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -109.56 82.96 1.68 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.954 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -110.62 -7.13 14.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.397 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.51 39.87 1.12 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.985 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.2 t -127.56 -28.19 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.528 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.454 ' N ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -52.85 -52.68 62.54 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.742 -179.703 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 81' ' ' SER . 73.6 Cg_endo -78.78 53.27 4.57 Favored 'Trans proline' 0 N--CA 1.465 -0.192 0 C-N-CA 122.894 2.396 . . . . 0.0 113.01 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 42.44 31.87 0.31 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.66 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -102.85 160.9 14.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.809 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.8 mttt -114.93 -68.42 0.92 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.997 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -169.21 -43.0 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.3 p -149.59 31.02 0.73 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.896 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 58.91 88.61 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.089 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -170.68 62.8 0.17 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.534 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -137.42 -170.13 11.81 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.562 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.8 t -134.15 152.97 52.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.762 0.315 . . . . 0.0 110.897 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.84 143.47 57.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.905 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.15 149.92 11.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.087 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -132.09 -82.12 0.22 Allowed Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.487 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER 59.77 78.6 0.26 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.87 0.367 . . . . 0.0 110.834 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -157.31 31.67 0.28 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.956 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.1 m -108.46 129.9 23.44 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.86 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.501 ' N ' ' CD ' ' A' ' 99' ' ' PRO . 31.9 Cg_exo -56.58 -45.91 33.7 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.358 2.038 . . . . 0.0 112.634 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.501 ' CD ' ' N ' ' A' ' 98' ' ' PRO . 83.1 Cg_endo -85.13 51.75 3.16 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.943 2.429 . . . . 0.0 112.393 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.16 102.95 11.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.082 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 2.3 t -110.55 87.21 6.23 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.936 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -68.52 81.42 0.56 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.559 2.173 . . . . 0.0 112.301 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 pp -170.63 117.03 0.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.935 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -160.92 30.56 0.15 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.927 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 2.1 mtm180 -137.93 131.26 30.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.819 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.461 ' CB ' ' CD ' ' A' ' 107' ' ' PRO . 9.8 mm100 -160.85 -65.65 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.958 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 106' ' ' GLN . 55.9 Cg_endo -69.93 -9.89 27.13 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.341 2.027 . . . . 0.0 112.611 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.2 p -56.85 154.48 9.24 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.802 0.334 . . . . 0.0 111.003 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -106.08 116.91 58.75 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.816 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -73.94 155.01 48.3 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.502 2.135 . . . . 0.0 112.454 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 147.38 71.97 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.586 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -63.63 76.04 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.705 2.27 . . . . 0.0 112.188 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -102.18 133.13 20.8 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.873 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.48 175.5 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.409 2.073 . . . . 0.0 112.245 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.44 94.75 9.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.874 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -139.55 -75.19 0.36 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.888 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -151.16 123.5 8.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.959 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 43.4 m -110.18 -31.4 7.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.806 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.84 22.62 10.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.143 0.497 . . . . 0.0 111.148 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.423 ' HB1' ' CE1' ' A' ' 122' ' ' HIS . . . 63.35 143.19 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.181 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.5 tttp -84.47 95.28 8.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.767 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.444 ' CD2' ' CG2' ' A' ' 40' ' ' THR . 73.3 m80 -91.16 103.11 15.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.089 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 6.6 t -81.81 118.06 28.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.725 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -49.25 -34.55 15.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.516 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.8 tp 60.22 -165.21 0.21 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.665 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 54.88 38.78 30.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.991 0.424 . . . . 0.0 110.773 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.7 mtt 173.42 -30.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.762 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.06 -167.75 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.296 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.448 ' CD1' ' N ' ' A' ' 129' ' ' TYR . 0.0 OUTLIER -159.77 120.13 3.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.62 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.465 ' CG2' ' N ' ' A' ' 131' ' ' SER . 2.4 p -94.52 159.53 2.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.31 0.576 . . . . 0.0 111.272 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.0 OUTLIER -169.1 125.46 0.92 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.862 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 -95.89 86.65 4.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.967 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -73.75 -179.77 3.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.881 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 20.5 m -134.75 116.34 14.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.844 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 7.4 p -59.32 156.17 31.4 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.978 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_exo -51.32 -25.17 17.45 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.67 2.247 . . . . 0.0 112.405 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 48.5 p -83.48 -41.15 18.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.998 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 56.55 62.58 6.25 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.975 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.01 -54.85 0.29 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.419 2.08 . . . . 0.0 112.58 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.463 ' N ' ' HD2' ' A' ' 141' ' ' PRO . 0.5 OUTLIER 176.22 -61.54 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.223 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 140' ' ' GLU . 12.2 Cg_endo -55.72 -20.73 29.26 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.547 2.165 . . . . 0.0 112.47 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 66.18 -166.69 0.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.743 0.306 . . . . 0.0 110.852 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -118.9 120.31 36.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.849 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.17 109.2 21.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.734 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -114.36 142.32 46.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 24.0 mt -146.31 107.18 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 11.7 m -92.77 133.38 36.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.052 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -108.5 150.21 27.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.406 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.24 30.69 2.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.294 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -116.3 45.78 1.71 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.075 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.22 23.49 3.2 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.145 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.408 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.5 mm-40 57.16 59.59 3.34 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.07 0.462 . . . . 0.0 111.084 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -85.74 158.61 19.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.545 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -157.98 91.66 1.13 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.206 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 6.6 m -92.02 117.87 36.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.219 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -110.26 83.18 1.71 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.778 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.3 mt -90.35 166.58 13.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.034 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.44 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 24.0 ttp180 -131.28 105.9 7.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.793 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -56.67 170.13 0.42 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.271 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.76 -30.49 20.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.988 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -119.11 168.87 10.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.931 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -78.02 -57.37 3.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.872 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -58.77 -35.38 72.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.173 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 168' ' ' TRP . 16.8 p -61.33 -51.89 66.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.919 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -58.67 -39.03 79.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.191 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.21 -45.42 66.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.716 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 4.9 m -67.42 -32.58 73.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.007 0.432 . . . . 0.0 110.254 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . 0.424 ' CZ3' HD21 ' A' ' 34' ' ' LEU . 5.1 m95 -72.98 -47.86 41.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.828 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . 0.449 ' O ' HG13 ' A' ' 130' ' ' VAL . . . -56.79 -58.57 7.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.315 0.579 . . . . 0.0 110.164 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.31 -40.13 60.11 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.558 -0.747 . . . . 0.0 112.588 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.35 -41.02 81.31 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.791 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.409 HG22 ' CD1' ' A' ' 176' ' ' ILE . 10.8 mt -59.64 -24.0 27.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 177.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -77.39 -37.57 51.73 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.013 179.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . 0.407 ' HA ' ' CG2' ' A' ' 178' ' ' THR . . . -59.35 -47.68 84.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.538 179.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -37.29 77.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.063 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . 0.44 HD13 HG12 ' A' ' 130' ' ' VAL . 49.3 mt -68.29 -29.15 43.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.039 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 152.02 -47.47 0.57 Allowed Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.398 -0.906 . . . . 0.0 112.936 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' THR . . . . . 0.407 ' CG2' ' HA ' ' A' ' 174' ' ' ALA . 9.6 t . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.304 -0.855 . . . . 0.0 111.349 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.799 0.333 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.2 t 60.79 102.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.889 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 173.29 75.48 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.506 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -38.53 91.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.726 0.298 . . . . 0.0 110.887 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.98 88.3 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.775 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -125.71 138.94 32.93 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.209 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -73.6 153.17 49.1 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.591 2.194 . . . . 0.0 112.375 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -93.83 142.24 27.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.823 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 38.1 p -140.77 161.61 37.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.943 0.402 . . . . 0.0 111.213 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.56 140.41 5.55 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.356 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 26.8 mt -61.14 120.72 10.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.927 0.394 . . . . 0.0 110.959 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.78 154.94 49.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.743 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.54 160.25 20.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.905 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.433 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 46.1 tp -141.31 126.44 18.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.632 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.43 ' CG ' ' NE1' ' A' ' 27' ' ' TRP . 2.4 ttm180 -69.34 178.37 2.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.618 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -162.18 93.96 0.89 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.852 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -136.37 138.45 9.87 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.51 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -167.03 -171.38 1.77 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.774 0.321 . . . . 0.0 111.235 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.28 -136.04 19.62 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.577 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.1 m -60.99 -171.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.753 0.311 . . . . 0.0 110.987 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -97.0 29.4 10.71 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.542 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -79.52 170.9 15.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.765 0.317 . . . . 0.0 110.987 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -110.37 42.03 2.08 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.582 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -105.82 42.83 1.81 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.381 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -68.52 179.27 1.73 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.791 0.329 . . . . 0.0 111.032 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.33 -174.51 3.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.813 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.433 ' CE3' ' C ' ' A' ' 14' ' ' LEU . 31.3 m95 -149.17 160.86 42.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.755 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.51 168.71 26.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.839 0.352 . . . . 0.0 111.068 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 -92.24 137.01 32.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.975 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.404 ' HB ' ' O ' ' A' ' 42' ' ' SER . 29.3 m -156.44 120.77 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.021 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.2 tp -69.73 128.24 35.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.703 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.5 mp -92.98 139.73 30.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.99 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 t -113.48 77.43 1.05 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.681 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.5 tp -72.99 96.25 2.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.86 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -96.29 148.09 23.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.905 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.26 -13.45 38.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.511 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -103.45 -19.03 14.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.391 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -176.2 174.42 2.02 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.968 0.413 . . . . 0.0 111.38 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -112.94 93.94 4.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.67 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.8 m -98.99 134.74 41.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.94 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 13.1 t -106.27 158.59 6.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.98 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.404 ' O ' ' HB ' ' A' ' 30' ' ' VAL . 14.9 p -146.56 152.12 44.7 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.787 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.72 44.48 1.43 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.611 2.207 . . . . 0.0 112.688 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 48.17 28.82 1.64 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.097 0.475 . . . . 0.0 111.188 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -57.85 102.45 0.1 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.916 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 137.52 85.06 0.15 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.556 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.9 mp0 -92.28 147.6 34.87 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.705 0.288 . . . . 0.0 111.019 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.43 165.05 33.51 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.64 2.227 . . . . 0.0 112.214 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 62.26 115.91 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.447 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -51.31 99.7 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.477 2.118 . . . . 0.0 112.286 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -140.51 93.88 8.59 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.958 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -52.8 -173.64 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.541 2.161 . . . . 0.0 112.334 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.65 163.31 2.76 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.982 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -64.24 -175.58 0.33 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.533 2.155 . . . . 0.0 112.303 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.31 134.88 29.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.125 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -89.61 87.25 6.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.942 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 5.3 mt -80.4 -31.56 37.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.914 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -89.16 121.6 31.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.871 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -131.58 97.06 0.34 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.503 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -141.05 129.09 21.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.815 0.34 . . . . 0.0 111.141 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 59.83 93.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.038 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -55.12 107.39 0.86 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.06 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -60.51 132.18 42.01 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.424 2.083 . . . . 0.0 112.223 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.39 -44.33 7.49 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.376 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -120.49 179.61 4.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.76 0.314 . . . . 0.0 111.029 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -93.35 129.94 37.25 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.106 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -74.43 155.14 45.76 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.495 2.13 . . . . 0.0 112.337 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -53.11 -174.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.553 2.169 . . . . 0.0 112.224 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.8 160.16 17.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.909 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.48 152.51 57.71 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.917 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -51.72 114.32 1.54 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.602 2.201 . . . . 0.0 112.348 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -152.55 68.33 0.84 Allowed 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.984 0.897 . . . . 0.0 110.719 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 178.09 -60.38 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 113.865 -1.516 . . . . 0.0 109.878 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.4 tt -90.01 -21.42 22.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.949 178.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.87 -35.96 20.25 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.462 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.5 tp -53.55 -27.43 26.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.221 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -57.53 -85.62 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.848 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.1 ttp85 74.15 -52.95 0.69 Allowed 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.08 56.2 0.32 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.986 0.422 . . . . 0.0 111.117 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 26.0 t -143.36 -45.21 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.869 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.416 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -139.48 123.31 10.92 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.748 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 81' ' ' SER . 15.3 Cg_exo -68.67 54.04 0.79 Allowed 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.669 2.246 . . . . 0.0 112.547 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.3 t80 176.18 39.13 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.742 0.306 . . . . 0.0 110.73 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -84.75 91.43 7.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.852 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.4 ptpt -172.89 170.47 4.54 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.89 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -130.4 169.01 16.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.792 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.44 -42.37 4.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.871 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -87.82 155.2 20.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.106 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 160.15 80.28 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.461 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -131.41 -136.53 3.91 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.474 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.6 t -167.03 159.61 13.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.834 0.35 . . . . 0.0 110.881 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.5 m -82.74 114.82 21.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.1 p -65.06 158.46 4.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.989 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.88 -104.1 0.15 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.501 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -158.46 74.76 0.7 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.884 0.373 . . . . 0.0 110.946 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 59.51 37.25 22.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.984 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.1 t -102.24 93.49 3.96 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.932 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -68.37 111.16 2.44 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.569 2.179 . . . . 0.0 112.327 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.37 -27.43 7.88 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.484 2.122 . . . . 0.0 112.352 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -136.36 103.72 5.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.124 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 3.2 p -81.34 116.43 62.74 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.864 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.14 62.47 4.15 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.442 2.095 . . . . 0.0 112.239 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.4 pp -151.48 -45.91 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.996 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -88.32 -45.2 10.22 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.832 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.81 149.26 24.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.918 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -98.24 100.93 9.91 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.837 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -67.98 123.47 10.7 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.406 2.071 . . . . 0.0 112.278 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 2.5 t -171.67 92.68 0.14 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.87 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.3 m 61.12 91.72 0.07 OUTLIER Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -68.14 155.6 68.9 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.515 2.143 . . . . 0.0 112.325 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -106.9 102.17 1.82 Allowed Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.455 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -50.26 148.63 13.85 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.526 2.151 . . . . 0.0 112.411 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.6 pm0 -87.55 156.22 53.48 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.836 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.33 115.56 3.24 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.639 2.226 . . . . 0.0 112.177 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 58.8 mtp180 -147.06 42.85 1.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.894 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -147.39 -55.2 0.23 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.866 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -162.43 105.19 1.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.856 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.35 133.61 34.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.854 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 61.16 166.53 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -84.54 164.69 18.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.198 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 44.8 tttp -105.38 84.74 2.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.89 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 10.5 m-70 -73.84 92.21 2.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.866 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 27.4 t -85.97 120.44 35.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.171 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 1.7 m -68.53 131.85 45.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.88 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.2 mp -87.88 -168.19 2.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.857 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.07 32.69 17.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.761 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 3.2 mtt -171.04 -41.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.001 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.23 -169.69 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.138 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -170.2 122.88 0.68 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.472 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.498 HG13 ' N ' ' A' ' 173' ' ' GLN . 2.3 p -96.45 158.8 3.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.342 0.591 . . . . 0.0 111.539 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.464 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 15.8 m -151.93 166.4 31.61 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.645 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.2 ttp180 -134.04 85.8 2.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.062 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.58 -168.12 0.79 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.872 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 53.8 m -122.51 132.59 54.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.916 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.404 HG22 ' CE2' ' A' ' 143' ' ' TYR . 0.2 OUTLIER -95.06 136.76 22.48 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.023 -179.934 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -79.26 -27.2 4.53 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.585 2.19 . . . . 0.0 112.568 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 20.4 p -79.37 -34.8 41.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.271 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -130.59 97.69 21.19 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.883 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.58 61.81 8.07 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.591 2.194 . . . . 0.0 112.751 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.497 ' CB ' ' HD3' ' A' ' 141' ' ' PRO . 1.7 mt-10 -169.66 -60.48 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.033 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.497 ' HD3' ' CB ' ' A' ' 140' ' ' GLU . 50.7 Cg_exo -53.08 -29.78 46.67 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.281 1.987 . . . . 0.0 112.141 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 62.94 152.95 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.84 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.404 ' CE2' HG22 ' A' ' 135' ' ' THR . 0.1 OUTLIER -89.46 132.91 34.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.879 -179.857 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -111.6 115.14 28.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.581 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -117.66 136.46 53.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.055 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 28.7 mt -135.94 104.24 4.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.978 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 29.7 m -90.1 136.42 33.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.957 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -114.65 150.8 34.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.041 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.06 30.92 1.76 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.5 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -110.67 42.81 1.52 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.035 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.68 25.71 2.54 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.118 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.411 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 5.8 mm-40 56.75 59.42 3.54 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.035 0.445 . . . . 0.0 110.934 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -94.08 162.75 13.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.805 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.39 93.42 0.85 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.182 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 6.6 m -83.23 128.31 38.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.13 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.423 ' CE1' ' HB3' ' A' ' 15' ' ' ARG . 0.2 OUTLIER -109.12 93.11 4.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.751 -179.91 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.3 mp -96.71 167.52 11.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.077 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.425 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -130.75 112.81 13.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.811 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -67.56 172.13 5.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.14 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -85.59 -66.05 0.94 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.024 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -97.96 170.86 8.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.881 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.01 -47.44 58.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.032 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.25 -38.4 90.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.139 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 30.4 t -61.75 -47.66 84.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.868 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -60.47 -41.2 93.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.224 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 51.9 mtp180 -70.08 -44.06 69.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.543 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.3 -34.32 77.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.054 179.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . 0.415 ' O ' HG13 ' A' ' 172' ' ' ILE . 11.2 m95 -74.26 -50.86 17.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.834 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -56.23 -51.58 67.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.399 0.619 . . . . 0.0 110.491 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.94 -40.81 95.82 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.798 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.21 -41.09 77.55 Favored 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.355 -179.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.438 HG21 ' HB ' ' A' ' 130' ' ' VAL . 6.8 mt -62.65 -23.18 31.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.498 ' N ' HG13 ' A' ' 130' ' ' VAL . 54.2 tt0 -80.66 -30.52 36.55 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.315 179.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.57 -47.34 76.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.338 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -70.55 -39.37 74.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.998 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . 0.412 ' CD1' HG23 ' A' ' 172' ' ' ILE . 84.5 mt -78.11 -9.95 12.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.195 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -86.6 26.88 6.12 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.448 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 3.2 t . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.919 -179.995 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.841 0.353 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.5 t -171.44 37.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.869 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -155.35 40.2 0.61 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.574 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 -101.82 -46.29 4.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.769 0.319 . . . . 0.0 110.871 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -81.99 169.15 17.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.891 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -134.68 95.96 15.37 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.98 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -67.65 154.8 72.38 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.513 2.142 . . . . 0.0 112.306 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.63 155.76 25.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.813 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 74.6 p -144.35 138.12 27.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.968 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -136.72 121.62 2.41 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.435 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.0 mt -68.53 114.09 6.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.876 0.37 . . . . 0.0 110.921 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.21 150.24 50.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.72 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -83.58 163.22 20.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.036 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 39.6 tp -130.95 126.63 36.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.636 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.478 ' HA ' ' CD2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.35 174.77 4.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.63 -179.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -165.16 59.12 0.12 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.954 0.406 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -141.51 30.98 2.17 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.532 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.11 108.62 18.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.875 0.369 . . . . 0.0 111.101 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 130.54 -98.12 0.4 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.507 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.3 p -168.08 161.4 12.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.795 0.331 . . . . 0.0 110.916 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.15 -49.18 0.9 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.474 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.57 125.72 27.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.929 0.395 . . . . 0.0 111.019 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -114.43 -28.0 3.17 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.605 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.18 15.63 60.15 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.75 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 57.0 104.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.788 0.328 . . . . 0.0 110.995 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.94 147.04 26.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.043 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.478 ' CD2' ' HA ' ' A' ' 15' ' ' ARG . 22.1 m95 -150.8 159.89 44.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.655 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -146.47 -175.02 4.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.994 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -109.98 137.34 47.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 26.2 m -151.19 128.02 2.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.12 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.2 tp -81.98 127.23 32.85 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.424 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -94.16 92.78 7.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.104 -179.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.15 89.22 1.49 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.579 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.6 tp -84.65 119.86 25.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.152 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -122.83 138.8 54.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.022 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -56.77 -23.2 41.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.462 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -89.55 -29.95 18.56 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.006 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -175.72 166.82 3.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.135 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.56 152.93 21.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.752 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 88.3 m -158.21 132.64 8.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.772 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.7 t -117.86 159.26 18.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.214 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -155.31 176.27 2.64 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.539 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -82.25 38.52 0.75 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.531 2.154 . . . . 0.0 112.841 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 48.89 28.68 2.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.116 0.484 . . . . 0.0 111.07 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -136.91 114.34 10.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.819 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 138.43 58.16 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.391 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -89.21 147.9 39.49 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.729 0.299 . . . . 0.0 110.851 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.12 93.51 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.6 2.2 . . . . 0.0 112.266 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 129.54 101.22 0.96 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.57 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -49.09 172.1 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.497 2.132 . . . . 0.0 112.305 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.447 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -179.37 -61.19 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.029 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 18.7 Cg_endo -59.88 82.84 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.452 2.101 . . . . 0.0 112.277 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -77.62 165.49 50.92 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.786 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -56.28 142.88 87.31 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.643 2.228 . . . . 0.0 112.16 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -134.51 -166.64 1.84 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.097 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 62.95 88.05 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.815 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.52 169.89 13.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.876 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.11 122.17 25.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.894 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 98.8 56.56 1.01 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.431 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -130.29 155.26 46.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.786 0.327 . . . . 0.0 111.074 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -100.86 158.98 15.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.06 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -97.99 143.75 26.8 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.939 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.16 113.92 1.57 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.561 2.174 . . . . 0.0 112.231 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -79.89 72.82 2.53 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.448 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -80.04 132.75 36.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.844 0.354 . . . . 0.0 111.115 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.418 ' N ' ' HD2' ' A' ' 67' ' ' PRO . . . -72.26 -59.53 2.62 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.251 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.418 ' HD2' ' N ' ' A' ' 66' ' ' ALA . 67.2 Cg_endo -75.21 154.6 41.62 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.932 2.422 . . . . 0.0 112.425 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.13 80.55 1.26 Allowed 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.545 2.164 . . . . 0.0 112.375 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -92.79 150.16 20.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.927 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 60.74 99.82 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.832 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.09 171.74 12.05 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.421 2.081 . . . . 0.0 112.275 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 64.56 70.79 0.48 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.353 0.597 . . . . 0.0 110.75 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 166.3 -33.02 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.652 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.4 tt -103.71 -30.25 10.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.006 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.434 HD11 ' N ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -74.62 -5.52 43.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.585 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.434 ' N ' HD11 ' A' ' 75' ' ' LEU . 0.8 OUTLIER -84.49 -49.15 8.89 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.855 0.36 . . . . 0.0 110.71 179.998 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -98.06 69.97 2.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.774 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -86.81 -40.29 15.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.897 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -98.15 31.45 2.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 20.7 t -126.89 -39.62 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.24 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.442 ' N ' ' HD2' ' A' ' 82' ' ' PRO . 0.4 OUTLIER -51.18 -56.75 17.55 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.368 -179.945 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.442 ' HD2' ' N ' ' A' ' 81' ' ' SER . 67.3 Cg_endo -75.72 59.26 5.61 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 122.933 2.422 . . . . 0.0 112.429 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER 57.02 171.93 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.067 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -173.61 138.9 0.69 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.829 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.75 101.1 0.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.976 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 60.35 100.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.817 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -133.71 -65.85 0.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.89 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -169.38 148.51 3.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.027 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -90.19 -43.3 5.03 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.531 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -178.42 -168.06 37.19 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.433 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.7 163.19 28.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.898 0.38 . . . . 0.0 110.983 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -167.28 103.67 0.53 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.831 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.2 p -99.19 145.86 9.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.072 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 171.12 -90.19 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.474 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 15.8 t90 60.94 83.3 0.15 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.821 0.343 . . . . 0.0 110.841 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 3.2 t0 60.68 52.35 4.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.84 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.4 t -149.55 74.28 9.64 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.94 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -55.39 169.93 0.96 Allowed 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.517 2.144 . . . . 0.0 112.161 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -66.82 -17.22 51.83 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.497 2.132 . . . . 0.0 112.492 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -82.53 109.78 17.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.166 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -140.81 164.84 33.68 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.874 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.31 -179.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.598 2.198 . . . . 0.0 112.24 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.4 mp -120.05 161.43 20.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.901 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -161.04 134.73 6.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.852 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -119.68 42.05 2.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.834 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -110.39 94.89 20.09 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.844 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -49.72 92.29 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.508 2.138 . . . . 0.0 112.44 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -143.94 137.89 28.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.922 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -149.4 169.28 9.42 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.798 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.89 151.67 15.24 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.562 2.174 . . . . 0.0 112.322 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -144.18 -178.42 19.88 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.546 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.41 98.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.569 2.18 . . . . 0.0 112.357 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -132.72 71.0 78.98 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.988 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.45 101.68 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.633 2.222 . . . . 0.0 112.312 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.75 119.08 36.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.816 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -152.1 -69.36 0.16 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.937 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 4.2 pp -108.46 149.66 28.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.01 -33.01 7.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.883 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -88.91 142.95 27.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.967 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -86.08 166.16 16.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.103 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -101.4 97.72 8.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.88 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -88.94 113.94 25.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.961 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.7 t -103.18 137.92 29.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.085 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.27 159.79 30.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.868 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -123.6 34.36 5.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.974 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.29 34.84 1.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.964 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 3.3 ptp 178.55 -37.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.0 -177.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.324 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -159.23 124.36 4.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.461 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.506 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.9 p -101.27 159.95 3.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.318 0.58 . . . . 0.0 111.497 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.461 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -161.45 156.13 23.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.994 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.65 139.72 53.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.772 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 -157.48 -173.0 4.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.793 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 3.8 p -118.24 176.26 5.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.022 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.406 ' CB ' ' HD3' ' A' ' 136' ' ' PRO . 0.1 OUTLIER -98.9 -52.51 0.2 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.303 -179.689 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . 0.406 ' HD3' ' CB ' ' A' ' 135' ' ' THR . 1.8 Cg_endo -84.95 12.49 3.06 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 123.015 2.477 . . . . 0.0 112.722 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.4 p 68.16 30.35 5.79 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.933 0.397 . . . . 0.0 110.38 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 52.3 p-10 -108.43 146.66 34.1 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.03 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -63.02 78.25 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.531 2.154 . . . . 0.0 112.115 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -165.51 107.77 0.76 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.805 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -47.59 98.23 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.56 2.173 . . . . 0.0 112.388 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 2.1 mtt85 -146.25 31.67 1.01 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.943 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -165.3 91.63 0.53 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.057 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.2 mt -94.23 116.14 28.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.753 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -108.98 130.29 55.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.87 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 35.6 mt -132.91 120.72 42.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.097 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 35.8 t -109.78 124.27 50.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.777 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -108.53 147.51 31.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.21 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.47 30.74 2.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.179 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -112.09 42.75 1.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.404 179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.68 25.28 2.17 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.955 -0.641 . . . . 0.0 112.359 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.56 60.55 2.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.068 0.461 . . . . 0.0 110.923 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -93.31 148.38 22.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.861 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -155.64 90.41 1.24 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.092 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 27.2 m -88.94 131.2 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.21 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -118.0 96.29 5.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.68 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -103.28 167.06 10.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.041 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.432 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 69.2 ttt180 -132.8 101.16 5.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.719 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.85 173.49 0.43 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.158 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.06 -33.27 10.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.935 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.03 -170.01 1.78 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.822 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -108.21 -56.66 2.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.71 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.39 -29.91 70.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.872 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 3.4 m -65.25 -47.48 76.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.504 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.54 -46.05 91.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.026 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -69.64 -37.91 76.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.518 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 88.5 p -70.01 -34.21 73.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.167 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 6.9 m95 -73.06 -48.88 32.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.865 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . 0.424 ' HA ' HG21 ' A' ' 130' ' ' VAL . . . -57.3 -51.82 67.82 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.359 0.599 . . . . 0.0 110.486 179.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.82 -40.87 93.62 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.748 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.96 76.39 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.049 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . . . . . . . . . 9.5 mt -61.62 -22.83 29.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.506 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -71.11 -55.53 8.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.477 179.239 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . 0.51 ' HA ' ' CG2' ' A' ' 178' ' ' THR . . . -52.73 -37.74 59.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.119 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.43 -30.46 57.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.311 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . . . . . . . . . 19.4 mt -71.33 -25.91 25.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.913 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 111.13 37.35 1.67 Allowed Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.788 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' THR . . . . . 0.51 ' CG2' ' HA ' ' A' ' 174' ' ' ALA . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.902 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.821 0.343 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.6 t -130.09 166.43 20.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.815 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -156.83 124.81 1.49 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.515 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.02 178.99 5.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.826 0.346 . . . . 0.0 110.85 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 10.9 mmt-85 -70.62 155.05 41.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.017 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -104.69 88.92 2.46 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.099 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -68.74 152.21 74.23 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.502 2.135 . . . . 0.0 112.452 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -97.56 143.42 28.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.977 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.0 p -141.44 154.6 45.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.938 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -159.6 135.79 4.3 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.535 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 66.4 mt -66.56 105.3 1.47 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.806 0.336 . . . . 0.0 110.989 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -116.26 152.34 34.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.819 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.427 ' HB3' ' CE3' ' A' ' 27' ' ' TRP . 4.5 tt0 -78.93 170.11 17.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.878 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.407 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 39.7 tp -145.33 120.81 10.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.74 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.468 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.2 OUTLIER -69.49 157.6 36.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.453 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -169.71 79.7 0.11 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.023 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -175.49 33.4 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.624 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 54.12 99.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.834 0.349 . . . . 0.0 111.227 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.01 87.87 0.38 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.659 -0.782 . . . . 0.0 112.556 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.1 m -112.72 -65.2 1.21 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.828 0.347 . . . . 0.0 110.95 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -174.19 -53.13 0.05 OUTLIER Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.455 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -151.16 129.24 11.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.802 0.334 . . . . 0.0 111.149 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -177.87 -68.47 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.459 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 163.42 74.12 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.428 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.33 131.92 52.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.784 0.326 . . . . 0.0 110.808 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 mtm180 -113.68 68.91 0.69 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.921 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.468 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 21.7 m95 -56.69 -178.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.776 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.56 175.88 5.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.88 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -105.62 127.03 52.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.958 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.4 m -141.46 130.26 23.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.109 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.7 tp -73.5 124.9 26.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.751 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.9 tp -92.39 125.38 37.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.972 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.14 87.89 3.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.78 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.427 ' CD1' ' CD1' ' A' ' 172' ' ' ILE . 4.8 tp -84.09 123.14 29.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.015 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -134.28 139.77 45.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.016 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.36 -23.53 49.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.103 0.478 . . . . 0.0 111.278 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -83.77 -31.17 26.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.89 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -174.62 169.1 3.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.262 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.76 106.58 14.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.723 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.405 HG21 ' CD2' ' A' ' 122' ' ' HIS . 28.0 m -115.7 132.04 56.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.997 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 17.6 t -106.24 160.15 5.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.921 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.44 167.17 9.62 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.764 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.63 148.45 65.93 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.571 2.181 . . . . 0.0 112.267 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -96.4 43.3 1.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.004 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -149.71 31.64 0.71 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.949 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 94.77 -160.88 23.52 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.638 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -112.53 161.67 25.22 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.694 0.283 . . . . 0.0 110.9 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -50.15 178.54 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.759 2.306 . . . . 0.0 112.234 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -105.05 90.81 0.72 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.633 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.76 -170.95 0.67 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.665 2.243 . . . . 0.0 112.179 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 58.72 88.74 0.12 Allowed Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.989 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -51.49 117.83 3.83 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.537 2.158 . . . . 0.0 112.395 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -98.71 98.59 6.3 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.864 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -67.86 84.64 0.41 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.4 2.067 . . . . 0.0 112.323 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -79.8 158.59 26.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.016 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -105.43 175.59 5.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.92 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.6 mp -90.54 166.08 13.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.919 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -143.69 85.21 1.82 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.98 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 121.23 125.57 3.2 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.425 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -112.63 150.6 31.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.821 0.343 . . . . 0.0 111.066 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 60.59 169.5 0.09 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.06 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 54.96 67.66 3.07 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.945 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.47 -173.44 0.02 OUTLIER 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.504 2.136 . . . . 0.0 112.238 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.95 -63.76 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.563 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -121.79 95.04 4.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.788 0.328 . . . . 0.0 111.103 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.408 ' CB ' ' CD ' ' A' ' 67' ' ' PRO . . . -73.21 -59.53 2.07 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.261 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.408 ' CD ' ' CB ' ' A' ' 66' ' ' ALA . 72.2 Cg_endo -75.91 162.52 34.69 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 123.002 2.468 . . . . 0.0 112.504 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -56.7 -163.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.666 2.244 . . . . 0.0 112.284 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -88.1 -176.27 5.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.919 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.1 mp -128.45 108.52 19.19 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.016 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.38 -165.78 0.18 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.509 2.139 . . . . 0.0 112.248 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 68.79 73.55 0.27 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.382 0.61 . . . . 0.0 110.714 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 170.26 -37.89 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.552 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.42 ' N ' ' CD1' ' A' ' 74' ' ' LEU . 5.9 mp -112.23 -17.66 12.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.171 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -95.47 -15.01 23.24 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.617 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.413 HD12 ' N ' ' A' ' 77' ' ' GLN . 0.0 OUTLIER -98.39 0.1 44.7 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.755 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.413 ' N ' HD12 ' A' ' 76' ' ' LEU . 18.4 pt20 -146.93 45.25 1.18 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.827 0.346 . . . . 0.0 111.087 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.17 -35.34 2.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.268 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -111.64 40.6 2.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.933 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 25.9 t -126.1 -48.36 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.148 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.4 m -64.69 162.91 31.82 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.841 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -79.17 49.94 3.33 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.101 2.534 . . . . 0.0 112.558 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 175.7 76.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.904 0.383 . . . . 0.0 110.589 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -109.11 150.73 27.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.908 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 168.29 1.29 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.998 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 16.9 p-10 -173.82 100.64 0.11 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.963 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -89.94 85.78 6.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.883 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -149.39 135.36 18.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.086 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 105.52 110.5 3.51 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.506 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -71.42 -81.72 0.29 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.614 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.98 146.79 37.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.868 0.366 . . . . 0.0 110.943 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -149.31 103.26 3.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.828 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.65 151.44 10.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.065 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 121.97 34.08 0.87 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.635 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 55.79 85.51 0.07 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.779 0.323 . . . . 0.0 111.013 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -170.4 45.39 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.809 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.3 t -129.7 80.51 71.48 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.871 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_exo -52.01 118.17 4.27 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.575 2.184 . . . . 0.0 112.232 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.65 -25.8 40.08 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.325 2.017 . . . . 0.0 112.321 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.22 147.26 36.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.096 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 95.9 p -121.35 92.35 48.57 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.888 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -50.43 102.88 0.06 OUTLIER 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.649 2.232 . . . . 0.0 112.35 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.2 mt 59.84 -179.08 0.09 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.914 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -164.24 79.76 0.39 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.785 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 57.2 mtt180 -139.59 148.89 43.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.922 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.414 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 0.0 OUTLIER -71.11 -61.62 2.21 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.131 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.414 ' HD2' ' N ' ' A' ' 106' ' ' GLN . 35.8 Cg_endo -65.21 154.24 74.46 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.454 2.103 . . . . 0.0 112.385 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 64.4 p -121.62 149.72 42.76 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.838 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.403 ' CB ' ' CD ' ' A' ' 110' ' ' PRO . 0.4 OUTLIER -74.28 -59.02 1.77 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.186 -179.994 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.403 ' CD ' ' CB ' ' A' ' 109' ' ' SER . 70.1 Cg_endo -75.93 163.56 33.1 Favored 'Trans proline' 0 N--CA 1.465 -0.177 0 C-N-CA 122.819 2.346 . . . . 0.0 112.493 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -161.18 62.66 0.28 Allowed Glycine 0 CA--C 1.519 0.297 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.449 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.01 147.15 27.25 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.538 2.158 . . . . 0.0 112.46 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -135.82 60.22 34.42 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.875 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.03 64.63 2.56 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.448 2.099 . . . . 0.0 112.341 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 mtt180 -76.34 157.01 32.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.846 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -170.84 -56.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.869 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 24.9 tp -139.98 62.98 1.49 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.826 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 74.6 m -65.46 -33.46 76.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.917 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -95.93 139.88 31.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.892 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.79 -170.14 0.4 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.085 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.06 78.03 1.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.861 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.405 ' CD2' HG21 ' A' ' 40' ' ' THR . 20.4 m-70 -71.46 146.75 48.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.057 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.4 t -149.45 113.29 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.067 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.18 147.73 52.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.064 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -98.31 -176.95 3.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.741 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 67.62 45.41 1.5 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.989 0.423 . . . . 0.0 110.95 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 178.45 -37.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.768 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.09 -176.57 0.72 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.173 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.455 ' CE1' ' HB3' ' A' ' 147' ' ' CYS . 53.3 p90 -162.23 115.15 1.74 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.807 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.473 ' CG2' ' N ' ' A' ' 131' ' ' SER . 1.6 p -78.78 158.92 4.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.274 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.473 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.9 OUTLIER -164.59 119.04 1.38 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.672 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 17.0 ptt-85 -94.05 86.35 4.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.866 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 10.0 mtt85 -69.92 178.12 2.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.869 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 19.0 p -127.63 153.38 46.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.935 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.418 HG23 ' CD1' ' A' ' 143' ' ' TYR . 13.3 p -104.41 158.21 32.45 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.829 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.42 -17.53 57.9 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.506 2.138 . . . . 0.0 112.446 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.57 32.82 4.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.045 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -57.62 109.33 1.7 Allowed Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.022 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -78.89 -22.2 9.0 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.454 2.102 . . . . 0.0 112.544 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.401 ' N ' ' CD ' ' A' ' 141' ' ' PRO . 0.3 OUTLIER -179.62 -52.48 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.198 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.107 179.875 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' A' ' 140' ' ' GLU . 45.3 Cg_exo -56.65 -164.57 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.462 2.108 . . . . 0.0 112.237 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.56 140.32 18.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.969 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.418 ' CD1' HG23 ' A' ' 135' ' ' THR . 0.1 OUTLIER -62.05 98.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.758 179.965 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.3 mt -84.94 86.15 7.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.638 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.41 131.41 53.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.902 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 28.8 mt -126.87 137.38 58.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.082 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . 0.455 ' HB3' ' CE1' ' A' ' 129' ' ' TYR . 0.8 OUTLIER -107.17 158.9 16.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.83 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -136.86 144.07 43.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.204 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.73 31.16 2.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.234 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -116.44 44.88 1.9 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.457 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.74 23.22 3.12 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.432 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 59.62 62.0 1.84 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.034 0.445 . . . . 0.0 110.798 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -94.76 156.42 16.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.814 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.82 93.64 0.82 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.152 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.2 m -83.19 130.13 36.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.162 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -106.56 89.56 3.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.837 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.3 mt -105.39 155.98 18.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.046 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.422 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 13.6 ttm180 -127.01 112.37 15.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.792 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -57.88 173.51 0.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.124 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.91 -31.11 11.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.99 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.92 -179.59 3.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -87.63 -59.16 2.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.875 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -62.24 -33.25 74.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.128 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.89 -44.86 84.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.753 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -64.37 -43.56 94.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.022 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.78 -41.07 75.61 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.158 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 60.5 p -65.32 -40.67 94.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . 0.555 ' O ' HG12 ' A' ' 172' ' ' ILE . 8.7 m95 -66.52 -55.59 14.83 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.505 179.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -46.02 -64.99 0.61 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.19 0.519 . . . . 0.0 110.897 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -49.7 -36.77 26.13 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.105 179.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.0 -40.35 78.77 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.968 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.555 HG12 ' O ' ' A' ' 168' ' ' TRP . 30.6 mm -59.68 -24.28 28.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 177.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.411 ' CA ' HG13 ' A' ' 130' ' ' VAL . 2.7 tt0 -75.71 -44.64 40.98 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.779 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . 0.483 ' HA ' ' CG2' ' A' ' 178' ' ' THR . . . -56.76 -48.69 77.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.169 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -71.21 -32.06 68.36 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.067 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . . . . . . . . . 7.0 mt -66.04 -28.85 44.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.619 179.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 116.18 43.25 0.67 Allowed Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.632 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' THR . . . . . 0.483 ' CG2' ' HA ' ' A' ' 174' ' ' ALA . 1.7 t . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.259 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.791 0.329 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.2 m -168.42 145.06 3.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.918 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -165.03 172.96 40.84 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.487 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.2 ttt-85 -116.22 91.27 3.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.865 0.364 . . . . 0.0 110.936 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.91 94.29 0.26 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.819 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -147.38 99.36 3.89 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.033 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -56.71 149.24 60.54 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.519 2.146 . . . . 0.0 112.395 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.96 121.31 42.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.423 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.0 p -132.25 139.56 48.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.014 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.82 143.35 12.15 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.485 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.7 mt -69.52 106.98 3.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.764 0.316 . . . . 0.0 110.891 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.95 144.22 49.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.649 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -84.02 155.82 22.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.948 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tp -136.09 137.78 41.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.664 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.473 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.61 -164.88 0.07 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.679 -179.814 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -174.59 40.86 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.91 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.13 107.04 2.07 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.53 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -88.48 120.22 29.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.822 0.344 . . . . 0.0 111.12 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 105.35 -174.83 21.5 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.56 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.14 131.05 42.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.791 0.329 . . . . 0.0 110.926 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 62.66 -164.39 26.35 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.409 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.95 97.08 8.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.847 0.356 . . . . 0.0 111.108 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -122.5 69.61 0.43 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.396 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.33 62.74 2.51 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.493 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.9 159.06 30.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.831 0.348 . . . . 0.0 110.98 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.9 mtm180 -135.69 77.74 1.68 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.804 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.473 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 26.9 m95 -53.33 111.59 0.73 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.139 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -108.6 146.86 32.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.806 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.7 ttt85 -72.9 136.07 45.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.008 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.4 ' HB ' ' O ' ' A' ' 42' ' ' SER . 35.1 m -141.17 169.95 14.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.109 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 tp -120.63 117.25 27.05 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.641 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -87.93 110.49 20.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.947 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.8 t -89.85 79.86 6.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.666 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tp -77.11 99.83 5.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.046 -179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.68 147.54 27.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.935 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -61.9 -16.22 48.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.444 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.49 -27.28 18.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.861 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -176.78 -179.74 1.0 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.974 0.416 . . . . 0.0 111.255 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -117.29 114.29 23.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.859 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.41 HG22 ' CD2' ' A' ' 122' ' ' HIS . 58.4 m -127.72 134.77 49.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.986 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.6 t -111.7 159.01 11.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.3 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.4 ' O ' ' HB ' ' A' ' 30' ' ' VAL . 9.9 p -148.04 160.64 37.05 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.372 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.11 47.43 2.23 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.496 2.131 . . . . 0.0 112.871 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 43.68 30.39 0.36 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.018 0.437 . . . . 0.0 111.549 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.9 121.45 15.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.924 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -84.54 -91.78 0.77 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.461 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -72.78 111.13 10.06 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.485 0.184 . . . . 0.0 110.841 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -68.78 102.19 0.85 Allowed 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.43 2.087 . . . . 0.0 112.273 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.01 69.23 0.81 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.423 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.26 105.41 1.56 Allowed 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.678 2.252 . . . . 0.0 112.252 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.407 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 0.1 OUTLIER -72.3 -56.71 4.04 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.966 179.92 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.407 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 72.2 Cg_endo -75.03 160.84 39.59 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.531 2.154 . . . . 0.0 112.293 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -109.04 151.86 42.16 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.003 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.91 115.48 4.27 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.541 2.161 . . . . 0.0 112.203 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -149.94 163.88 36.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.169 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -80.23 -25.71 39.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.995 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -95.75 21.83 7.99 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.172 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -95.67 -31.29 13.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.769 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.12 165.31 35.75 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.518 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -83.07 155.57 23.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.857 0.361 . . . . 0.0 111.078 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -164.71 108.38 0.9 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.17 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.88 84.43 0.2 Allowed Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.984 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.42 138.62 56.51 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.571 2.18 . . . . 0.0 112.368 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 132.27 138.78 4.19 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.563 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 59.73 93.1 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.827 0.346 . . . . 0.0 111.189 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.92 156.17 27.4 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.073 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.01 146.2 30.53 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.635 2.224 . . . . 0.0 112.29 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.85 62.62 3.14 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.381 2.054 . . . . 0.0 112.378 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -87.26 137.76 32.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.89 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.42 88.57 7.63 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.859 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.9 -178.03 1.85 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.537 2.158 . . . . 0.0 112.349 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 65.18 71.48 0.45 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.414 0.625 . . . . 0.0 110.712 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 169.51 -48.43 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.603 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -90.42 -32.4 16.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.61 179.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.72 -14.11 62.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.424 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.2 -42.69 11.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.867 0.365 . . . . 0.0 110.894 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -72.77 84.97 1.21 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.951 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.55 -48.27 0.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.821 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.421 ' HB2' ' CD1' ' A' ' 84' ' ' PHE . 2.4 pt-20 -112.15 31.82 5.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.885 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.2 t -141.27 -47.06 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.224 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.417 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.4 OUTLIER -66.92 -54.58 20.26 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.182 179.994 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 81' ' ' SER . 86.9 Cg_endo -82.96 47.55 2.47 Favored 'Trans proline' 0 N--CA 1.464 -0.214 0 C-N-CA 123.123 2.549 . . . . 0.0 112.638 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 60.87 152.76 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.049 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.421 ' CD1' ' HB2' ' A' ' 79' ' ' GLU . 4.9 t80 -178.45 77.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.841 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.18 161.42 27.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.908 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -141.6 168.34 20.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.884 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.7 m -128.72 153.52 47.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -78.22 145.01 35.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.142 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.48 147.04 4.79 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.483 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 156.18 43.83 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.559 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.0 p -69.34 77.91 0.38 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.815 0.341 . . . . 0.0 111.015 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.37 21.68 5.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.113 0.482 . . . . 0.0 111.239 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.0 p -59.71 128.31 20.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.094 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 167.6 42.62 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.497 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -151.79 75.03 1.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.847 0.356 . . . . 0.0 110.894 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -108.92 39.62 1.99 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.972 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -153.21 90.42 3.5 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.886 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -68.5 111.07 2.44 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.647 2.231 . . . . 0.0 112.295 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -78.92 -27.66 4.52 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.437 2.091 . . . . 0.0 112.47 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -103.81 176.28 5.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.249 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 8.7 t -167.58 78.41 0.92 Allowed Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.667 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -68.78 173.15 10.49 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.648 2.232 . . . . 0.0 112.41 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.2 mp -94.93 -23.04 17.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.084 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 67.83 157.37 0.13 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.892 0.377 . . . . 0.0 110.937 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 58.6 mtt-85 -90.18 162.18 15.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.963 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.26 77.35 0.4 Allowed Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.905 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.91 -45.25 1.01 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.481 2.121 . . . . 0.0 112.32 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.69 -68.43 0.38 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.9 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.32 159.62 0.11 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.952 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -69.29 139.81 42.82 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.622 2.214 . . . . 0.0 112.294 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -145.62 -155.24 6.41 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.508 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.26 151.1 18.11 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.574 2.183 . . . . 0.0 112.309 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.17 120.59 71.46 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.801 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.37 130.06 36.64 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.437 2.091 . . . . 0.0 112.358 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 14.6 mtt180 -163.31 33.93 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.889 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -79.74 140.75 36.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.891 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 15.7 tp 67.79 -69.63 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.924 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 67.27 -71.71 0.1 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.006 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.25 135.18 54.1 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.831 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.66 157.16 32.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.131 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 17.1 mttm -101.8 90.66 4.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.928 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.41 ' CD2' HG22 ' A' ' 40' ' ' THR . 19.7 m80 -84.98 138.91 32.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 19.2 t -138.45 116.88 13.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.074 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 92.5 p -70.8 125.15 26.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.905 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.52 -179.48 0.84 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.917 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 60.48 35.77 20.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.859 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.5 mmt -164.74 -44.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.89 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.64 -165.54 0.06 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.256 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -169.86 127.07 0.87 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.503 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.465 ' CG2' ' N ' ' A' ' 131' ' ' SER . 2.5 p -99.84 158.88 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.361 0.6 . . . . 0.0 111.646 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -166.5 133.0 2.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.677 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 39.4 ptt85 -102.96 96.05 6.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.846 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -114.48 176.79 4.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.914 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 23.3 p -113.83 -164.34 0.92 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.762 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.446 HG22 ' HD2' ' A' ' 136' ' ' PRO . 0.5 OUTLIER -164.38 -62.44 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.013 179.784 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . 0.446 ' HD2' HG22 ' A' ' 135' ' ' THR . 20.4 Cg_endo -62.68 -72.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.127 1.885 . . . . 0.0 112.265 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 7.6 t -159.56 28.32 0.19 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.904 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 27.5 t70 51.4 65.6 6.34 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.163 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.77 -60.78 0.22 Allowed 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.464 2.11 . . . . 0.0 112.241 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.414 ' CB ' ' HD3' ' A' ' 141' ' ' PRO . 0.5 OUTLIER 177.49 -53.18 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.957 179.925 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.414 ' HD3' ' CB ' ' A' ' 140' ' ' GLU . 45.0 Cg_exo -56.65 -27.04 68.23 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.493 2.128 . . . . 0.0 112.318 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.8 mtt85 61.41 163.63 0.08 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.948 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.452 ' CZ ' ' CD ' ' A' ' 158' ' ' ARG . 15.0 m-85 -110.28 123.05 49.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.904 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 80.8 mt -83.58 132.63 34.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.777 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -133.68 125.36 28.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.789 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 22.8 mt -130.46 117.99 41.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.187 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 35.5 m -100.3 143.55 30.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.829 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -112.77 149.01 33.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.308 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.92 30.58 2.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.255 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -120.98 48.15 1.69 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.074 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.35 19.11 3.58 Favored Glycine 0 N--CA 1.451 -0.332 0 CA-C-N 115.615 -0.72 . . . . 0.0 112.173 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.406 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.8 mm-40 58.45 61.14 2.34 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 121.123 0.487 . . . . 0.0 111.063 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -87.6 161.97 17.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.835 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.61 93.7 0.84 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.1 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.0 m -85.71 124.57 40.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.029 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -105.98 106.06 16.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.765 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.8 mt -113.76 164.6 13.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.076 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.452 ' CD ' ' CZ ' ' A' ' 143' ' ' TYR . 1.3 tpt180 -130.96 97.29 4.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.694 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -55.52 174.15 0.11 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.413 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -88.85 -67.21 0.85 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.003 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.39 173.84 7.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.105 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.52 -34.01 25.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.923 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -74.2 -46.33 42.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.936 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' A' ' 168' ' ' TRP . 0.4 OUTLIER -62.5 -39.97 95.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.651 179.757 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.69 -42.34 86.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.997 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.7 mtt180 -70.7 -40.68 72.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.55 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 41.9 p -67.98 -33.05 73.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.145 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . 0.405 ' HB2' ' O ' ' A' ' 164' ' ' SER . 7.7 m95 -73.0 -50.86 20.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.875 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -56.45 -50.06 72.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.306 0.574 . . . . 0.0 110.467 179.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.26 -42.2 95.32 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.647 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.04 -40.53 78.54 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.964 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.468 HG22 ' CD1' ' A' ' 176' ' ' ILE . 31.8 mt -60.89 -24.51 32.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.462 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.1 OUTLIER -81.77 -28.78 33.09 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.219 179.161 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.76 -50.54 66.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.128 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -67.29 -41.54 85.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.856 178.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . 0.468 ' CD1' HG22 ' A' ' 172' ' ' ILE . 83.1 mt -77.39 -5.59 7.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.224 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -86.55 25.56 7.18 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.541 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 5.4 t . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.889 -179.984 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.736 0.303 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.3 m -144.4 -177.43 5.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.903 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 156.98 -78.84 0.19 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.459 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.44 28.93 18.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.701 0.286 . . . . 0.0 110.949 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.93 130.47 55.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.948 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -160.26 139.05 7.74 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.045 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -68.86 141.26 48.5 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.52 2.146 . . . . 0.0 112.36 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.4 ttm105 -70.59 133.98 47.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.874 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 75.2 p -135.17 138.86 44.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.005 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.51 126.88 2.9 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.38 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 64.4 mt -68.85 99.38 1.03 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.823 0.344 . . . . 0.0 110.937 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.03 151.17 24.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.788 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -88.35 134.79 33.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.5 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 20.6 tp -108.39 139.17 43.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.495 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.516 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.46 -167.22 0.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.746 0.307 . . . . 0.0 110.918 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -170.93 82.33 0.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.895 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -149.53 -109.95 0.52 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.528 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 60.38 31.62 20.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.74 0.305 . . . . 0.0 111.137 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -95.64 -106.91 2.19 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.516 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.32 -55.2 2.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.81 0.338 . . . . 0.0 110.934 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -145.71 165.93 27.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.422 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.01 116.49 14.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.845 0.355 . . . . 0.0 111.134 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 173.07 79.8 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.434 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.53 69.43 0.66 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.44 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -88.57 158.93 18.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.391 . . . . 0.0 110.942 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -123.14 60.44 1.05 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.722 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.516 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 33.5 m95 -57.56 98.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.075 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -89.65 -176.69 5.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.686 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.41 130.08 54.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.851 0.358 . . . . 0.0 110.911 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 33.8 m -137.11 134.14 47.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.264 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 10.5 tp -78.86 128.12 32.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.7 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.38 123.6 43.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.045 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.1 t -97.51 89.87 4.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.708 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.415 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 2.5 tp -93.56 95.11 9.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.04 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.46 153.11 22.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.915 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -64.44 -14.04 54.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.409 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -96.13 -21.94 17.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.094 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -178.15 174.2 1.38 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.844 0.354 . . . . 0.0 111.134 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 21.6 tp -131.21 97.5 4.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.773 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.406 HG21 ' CD2' ' A' ' 122' ' ' HIS . 51.8 m -111.53 137.44 49.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.946 -179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.6 t -100.25 159.55 3.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.047 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -170.05 149.71 3.43 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.814 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.89 153.06 16.0 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.511 2.141 . . . . 0.0 112.13 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -93.05 49.34 1.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.122 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -141.91 155.93 45.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.953 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 153.77 48.34 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.499 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.87 114.36 61.78 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.502 0.192 . . . . 0.0 110.945 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -72.32 173.74 12.61 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.387 2.058 . . . . 0.0 112.325 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 165.25 -102.13 0.19 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.554 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -74.68 112.1 3.47 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.555 2.17 . . . . 0.0 112.345 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.45 ' N ' ' CD ' ' A' ' 52' ' ' PRO . 1.0 OUTLIER -78.34 -48.39 1.92 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.399 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.45 ' CD ' ' N ' ' A' ' 51' ' ' GLU . 96.5 Cg_endo -79.74 118.01 3.74 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.293 1.995 . . . . 0.0 112.436 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -106.68 100.53 31.41 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.943 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.8 179.04 2.91 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.424 2.083 . . . . 0.0 112.301 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -77.18 172.89 12.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.099 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -107.58 -74.87 0.64 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.888 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 61.4 31.74 19.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.803 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -157.58 137.5 12.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -129.77 28.68 3.91 Favored Glycine 0 C--N 1.331 0.258 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.448 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.17 172.54 8.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.69 0.281 . . . . 0.0 111.126 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -148.55 125.33 11.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.042 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -90.04 133.32 33.88 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.888 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.08 170.93 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.429 2.086 . . . . 0.0 112.258 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -177.9 50.08 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.563 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 59.68 38.01 22.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.784 0.326 . . . . 0.0 111.08 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 60.99 66.2 1.76 Allowed Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.046 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.82 170.6 17.45 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.536 2.157 . . . . 0.0 112.367 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.52 129.57 17.0 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.524 2.149 . . . . 0.0 112.297 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -109.85 154.04 23.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.954 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -83.57 114.61 54.69 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.886 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.66 -175.46 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.42 2.08 . . . . 0.0 112.362 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 64.06 70.55 0.5 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.422 0.63 . . . . 0.0 110.647 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 167.36 -44.92 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.563 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.9 mp -94.34 -37.18 11.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.742 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.62 -15.15 62.47 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.409 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.07 -28.96 32.09 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.859 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -138.94 97.5 3.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.858 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.92 -23.98 14.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.182 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -96.34 31.57 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.194 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 37.7 t -124.19 -3.67 6.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.661 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.478 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -76.78 -50.03 2.54 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-O 120.938 0.399 . . . . 0.0 111.119 179.974 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 81' ' ' SER . 47.5 Cg_endo -93.6 -141.57 0.02 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 123.615 2.877 . . . . 0.0 111.521 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.423 ' H ' ' HB2' ' A' ' 82' ' ' PRO . 0.1 OUTLIER -100.79 86.61 3.13 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.818 -179.885 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -152.3 130.98 12.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.83 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -155.73 -176.1 5.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.896 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -133.75 -49.28 0.82 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.881 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 73.4 m 60.28 34.96 20.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.911 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -97.65 30.71 2.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.158 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -116.93 -179.78 17.67 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.503 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -132.84 127.5 4.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.53 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.0 t -89.03 141.19 28.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.814 0.34 . . . . 0.0 110.833 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.7 m -116.54 142.5 46.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.876 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.1 p -62.27 118.65 4.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.092 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 166.19 80.34 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.535 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.412 ' CE3' ' HA ' ' A' ' 95' ' ' TRP . 0.1 OUTLIER -177.58 100.81 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.734 0.302 . . . . 0.0 110.843 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -143.71 44.32 1.49 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.977 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -173.89 136.88 0.67 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.981 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.13 167.62 25.61 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.458 2.105 . . . . 0.0 112.429 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.34 -16.71 31.14 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.624 2.216 . . . . 0.0 112.534 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.7 139.16 45.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.907 0.384 . . . . 0.0 111.257 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.71 134.35 21.31 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.83 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.32 151.92 27.64 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.405 2.07 . . . . 0.0 112.333 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.2 mm? 61.59 119.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.042 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -165.15 99.8 0.74 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.847 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.09 -52.38 4.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.916 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -101.5 146.33 32.03 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.958 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.53 138.77 30.22 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.506 2.137 . . . . 0.0 112.244 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 67.2 m -101.16 106.57 17.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.907 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 53.6 p -70.66 148.74 95.19 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.884 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.2 -170.21 0.47 Allowed 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.611 2.207 . . . . 0.0 112.303 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -138.89 61.71 0.57 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.574 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -57.4 -177.34 0.08 OUTLIER 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.542 2.162 . . . . 0.0 112.242 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.69 84.91 0.2 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.022 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.65 158.4 55.89 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.58 2.187 . . . . 0.0 112.283 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 56.4 mtt-85 -74.29 108.22 6.95 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.92 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.8 p-10 -97.55 -32.13 11.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.872 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.89 -69.69 0.38 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.812 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 39.9 m 61.04 -82.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.24 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.7 -169.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.063 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -131.73 -174.86 3.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.06 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 31.8 mttt -131.74 91.51 3.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.951 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.406 ' CD2' HG21 ' A' ' 40' ' ' THR . 36.6 m80 -70.1 134.49 48.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.763 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 22.0 t -133.65 116.86 25.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.079 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 5.1 m -62.46 164.5 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.984 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -124.48 33.55 5.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.911 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -145.33 35.93 1.09 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.891 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.5 tpt -178.67 -37.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.994 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.12 -169.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.306 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -167.87 122.85 1.0 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.537 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.502 HG13 ' N ' ' A' ' 173' ' ' GLN . 2.2 p -98.61 159.31 3.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.288 0.565 . . . . 0.0 111.525 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.473 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 12.5 m -162.94 157.7 21.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.743 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . 0.404 ' NH1' ' HB3' ' A' ' 132' ' ' ARG . 12.7 ttp-105 -140.09 117.95 11.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.956 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -117.01 -175.1 2.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.831 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 26.0 p -111.5 -177.94 3.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.063 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 16.4 p -139.46 158.63 68.22 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.837 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -60.25 -17.03 44.12 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.765 2.31 . . . . 0.0 112.801 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.1 p -135.66 37.05 2.88 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.674 0.273 . . . . 0.0 111.112 -179.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.55 111.14 15.42 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.934 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -68.85 -42.24 4.7 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.609 2.206 . . . . 0.0 111.971 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.495 ' CB ' ' HD3' ' A' ' 141' ' ' PRO . 1.6 mt-10 -164.25 -56.77 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.927 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.495 ' HD3' ' CB ' ' A' ' 140' ' ' GLU . 24.6 Cg_exo -62.85 106.27 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.376 2.051 . . . . 0.0 112.039 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.27 160.7 18.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.026 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -75.39 141.68 43.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.867 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 7.1 mt -120.39 126.51 50.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.793 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -134.53 132.16 38.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.885 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.449 HG21 HD11 ' A' ' 146' ' ' ILE . 18.5 mt -129.49 125.8 62.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.128 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 30.4 p -104.74 130.96 52.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -110.18 147.31 33.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.167 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.97 30.57 2.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.306 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -115.74 45.29 1.73 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.191 0.519 . . . . 0.0 110.139 179.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 118.68 22.16 3.73 Favored Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.191 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.4 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.0 mm-40 58.74 61.65 2.13 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 121.14 0.495 . . . . 0.0 110.826 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -88.12 158.96 18.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.802 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -157.21 85.44 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.191 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 4.7 m -80.0 123.82 37.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.192 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -105.91 106.54 17.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.644 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.1 mt -119.85 160.85 21.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.151 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.402 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 22.5 ttt180 -132.46 107.74 8.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.764 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.68 173.05 0.44 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.228 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.02 -29.4 14.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.888 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -123.66 143.99 49.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.906 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -45.96 82.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.962 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.71 -39.94 88.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.007 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 68.4 m -61.91 -48.92 78.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.686 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -59.52 -39.75 84.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.031 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 5.0 mtt85 -69.9 -46.71 64.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.41 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.5 t -64.51 -33.23 75.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.219 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . 0.415 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -72.93 -51.25 19.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.845 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -55.72 -56.26 22.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.309 0.576 . . . . 0.0 110.516 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.41 -36.85 78.79 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.752 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -71.84 -39.86 69.46 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.157 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.432 HG21 ' HB ' ' A' ' 130' ' ' VAL . 7.4 mt -63.58 -22.2 30.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.606 -0.886 . . . . 0.0 108.606 177.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.502 ' N ' HG13 ' A' ' 130' ' ' VAL . 1.2 tp60 -77.76 -40.88 39.45 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.483 179.546 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . 0.515 ' HA ' ' CG2' ' A' ' 178' ' ' THR . . . -65.49 -33.05 75.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.766 179.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -29.39 30.29 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.09 179.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . . . . . . . . . 17.2 mt -71.59 -27.75 29.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.691 179.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 115.56 39.22 0.93 Allowed Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.612 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' THR . . . . . 0.515 ' CG2' ' HA ' ' A' ' 174' ' ' ALA . 1.6 t . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.182 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.898 0.38 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.08 -175.39 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.96 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 167.29 178.17 39.38 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.46 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 5.5 ttt85 -131.08 -47.07 1.01 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.789 0.328 . . . . 0.0 110.863 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.63 97.24 2.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.897 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -165.03 88.56 1.01 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.15 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -69.3 156.08 65.56 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 122.552 2.168 . . . . 0.0 112.356 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.403 ' CZ ' ' HB3' ' A' ' 8' ' ' ARG . 4.3 ptp180 -112.93 135.69 53.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.868 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.4 p -124.61 168.44 13.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.966 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.55 126.71 1.25 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.47 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.5 mt -59.68 128.05 35.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.843 0.354 . . . . 0.0 110.932 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.48 140.68 27.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.806 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.95 154.93 37.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.939 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 16.1 tp -134.73 130.96 37.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.452 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.506 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 2.6 ttp180 -69.38 166.98 17.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.801 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.4 t -124.91 -43.13 2.0 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.849 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 131.37 170.31 12.61 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.598 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.58 131.34 38.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.875 0.369 . . . . 0.0 111.085 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 128.53 52.16 0.12 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.524 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 p -145.26 -58.9 0.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.771 0.319 . . . . 0.0 110.933 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -145.32 -142.29 3.8 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.542 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -81.32 139.63 35.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.752 0.31 . . . . 0.0 111.175 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.93 -49.48 0.88 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.499 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 100.62 24.66 9.16 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.568 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -155.09 149.61 26.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.835 0.35 . . . . 0.0 110.799 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.47 49.17 2.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.825 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.506 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 43.0 m95 -48.13 160.13 0.16 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.02 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -153.17 158.08 41.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.095 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -82.34 123.56 29.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.946 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 20.5 m -143.31 123.22 9.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.209 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.85 134.85 48.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.613 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.84 121.85 41.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.979 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.2 t -100.37 86.0 3.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.694 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 tp -80.27 129.65 34.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.028 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -135.26 138.67 43.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.06 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.72 -23.69 44.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.037 0.446 . . . . 0.0 111.285 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -88.83 -30.15 19.16 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.929 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -175.41 173.01 2.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.032 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -114.71 129.01 56.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.942 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 28.6 m -128.33 129.65 46.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.752 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 13.9 t -107.28 159.02 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.317 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.3 t -159.59 149.0 14.46 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.451 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -75.07 43.03 0.92 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.654 2.236 . . . . 0.0 113.23 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 45.52 29.51 0.63 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.939 0.399 . . . . 0.0 111.846 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -111.56 -168.52 1.32 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.017 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -112.85 -158.44 13.47 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.484 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -144.73 92.98 5.77 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.651 0.262 . . . . 0.0 110.959 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -68.57 163.1 38.17 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.466 2.111 . . . . 0.0 112.284 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -108.21 -94.5 2.34 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.547 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.65 108.56 0.26 Allowed 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.554 2.169 . . . . 0.0 112.326 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -147.86 138.75 13.21 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.793 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.16 135.68 27.66 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.424 2.083 . . . . 0.0 112.299 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -73.49 116.04 47.43 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.788 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.32 63.79 1.54 Allowed 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.41 2.073 . . . . 0.0 112.287 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -152.67 155.3 37.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.097 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.24 93.52 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.888 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.8 mt -76.21 -54.7 6.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.923 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.3 t30 60.84 31.26 20.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.849 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.0 -158.89 22.28 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.549 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.58 105.16 3.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.863 0.363 . . . . 0.0 111.129 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -107.11 135.07 49.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.029 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -80.99 135.19 51.73 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.877 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.49 127.21 10.86 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.511 2.141 . . . . 0.0 112.325 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -109.77 147.53 17.15 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.514 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.14 -177.35 0.11 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.767 0.318 . . . . 0.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -130.26 99.31 19.61 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.066 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.86 157.43 61.83 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.43 2.087 . . . . 0.0 112.303 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.79 136.16 29.63 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.617 2.211 . . . . 0.0 112.358 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -98.61 126.2 44.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.908 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 60.05 108.61 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.841 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -57.59 -160.7 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.47 2.113 . . . . 0.0 112.21 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.417 ' HA ' HD13 ' A' ' 75' ' ' LEU . 2.8 mt-10 66.3 74.5 0.35 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.458 0.647 . . . . 0.0 110.211 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 165.0 -28.67 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.795 -1.093 . . . . 0.0 110.327 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 7.6 mt -115.19 -18.66 11.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.193 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.462 HD11 ' N ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -99.43 -2.72 35.39 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.555 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.462 ' N ' HD11 ' A' ' 75' ' ' LEU . 2.6 pt? -57.43 -44.39 84.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.765 0.317 . . . . 0.0 111.489 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.451 ' N ' ' HG ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER 46.86 28.59 0.86 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.391 179.889 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -120.73 -36.18 3.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.186 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -98.99 31.63 2.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.903 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.4 t -143.76 -46.4 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.187 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 9.9 t 62.85 142.98 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.966 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.09 59.06 6.4 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.619 2.213 . . . . 0.0 112.424 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -170.29 74.04 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.894 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -155.99 153.48 29.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.946 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt -65.73 158.72 26.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.937 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -126.88 31.33 5.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.952 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.96 92.18 8.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.837 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -164.04 174.09 11.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.038 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 166.57 -148.92 14.12 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.56 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 126.12 58.6 0.15 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.501 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 15.1 t 45.19 -167.22 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.812 0.339 . . . . 0.0 111.315 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 56.1 m -90.82 113.45 25.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.903 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.9 p -88.64 148.66 4.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.131 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 155.57 -61.31 0.36 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.488 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER 60.68 83.98 0.13 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.855 0.36 . . . . 0.0 110.914 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -176.68 67.53 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.854 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 66.7 m -115.6 84.84 12.88 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.063 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -52.15 128.12 26.06 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.594 2.196 . . . . 0.0 112.172 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -64.29 -27.13 63.76 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.379 2.053 . . . . 0.0 112.09 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -132.76 127.7 35.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.021 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.3 p -117.48 86.22 22.22 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.917 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -69.01 147.07 66.9 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.599 2.2 . . . . 0.0 112.255 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.54 100.62 9.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -105.63 160.66 15.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.819 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.47 149.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.89 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.4 138.82 89.13 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.812 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.19 168.24 0.61 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.485 2.123 . . . . 0.0 112.294 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.9 t -91.34 166.22 13.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.878 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.429 ' CB ' ' CD ' ' A' ' 110' ' ' PRO . 0.4 OUTLIER 179.41 -60.89 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.068 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 109' ' ' SER . 62.8 Cg_endo -74.33 125.16 9.49 Favored 'Trans proline' 0 N--CA 1.466 -0.145 0 C-N-CA 122.855 2.37 . . . . 0.0 112.315 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 77.4 105.77 0.16 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.46 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -49.53 164.06 0.38 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.539 2.16 . . . . 0.0 112.367 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -75.23 147.5 82.98 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.08 162.13 42.66 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.557 2.172 . . . . 0.0 112.301 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.38 177.75 10.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.824 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -69.21 -45.57 69.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.783 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 19.6 tp -166.53 115.98 0.92 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.907 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 2.7 m -111.77 -33.52 6.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.987 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -111.63 -177.94 3.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.97 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -86.67 154.36 21.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.187 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 94.11 6.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.803 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -86.33 104.54 15.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.996 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.2 t -108.19 139.89 28.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.039 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.9 152.21 19.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.961 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.8 tp -131.95 31.47 4.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.903 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.95 41.74 2.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.724 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 174.88 -32.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.914 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.4 ' CB ' ' HA ' ' A' ' 148' ' ' ALA . . . -54.32 -171.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.378 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -161.23 107.1 1.38 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.587 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.472 HG13 ' N ' ' A' ' 173' ' ' GLN . 1.6 p -80.23 158.64 4.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.233 0.539 . . . . 0.0 111.359 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.472 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.4 OUTLIER -160.48 150.04 17.53 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.646 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.5 ptt85 -124.0 111.48 16.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.086 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.49 177.74 4.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.816 179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 30.5 p -100.66 137.38 39.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.989 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.07 140.7 21.51 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.744 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.22 -15.59 18.05 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.593 2.195 . . . . 0.0 112.659 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 66.6 p -78.03 -45.31 24.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.917 0.389 . . . . 0.0 111.068 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -136.19 144.87 49.74 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.906 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -83.6 -44.84 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.753 2.302 . . . . 0.0 112.789 -179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.481 ' CB ' ' HD3' ' A' ' 141' ' ' PRO . 0.2 OUTLIER -64.87 -57.66 15.4 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.316 -179.514 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.481 ' HD3' ' CB ' ' A' ' 140' ' ' GLU . 46.1 Cg_exo -56.29 103.86 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.344 2.029 . . . . 0.0 112.221 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.58 116.98 20.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.737 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -57.89 119.41 6.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.829 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 91.4 mt -96.2 139.88 31.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.918 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -148.1 130.02 15.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.729 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 14.8 mt -130.89 123.26 53.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.295 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 60.1 m -108.42 119.38 39.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.667 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . 0.4 ' HA ' ' CB ' ' A' ' 128' ' ' ALA . . . -100.11 143.14 30.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.377 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.58 30.89 2.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.167 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -121.35 47.8 1.78 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.381 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 125.69 18.7 2.39 Favored Glycine 0 CA--C 1.519 0.292 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.524 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.95 60.93 2.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.973 0.416 . . . . 0.0 110.925 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -93.44 152.94 18.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.713 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -160.49 86.88 0.74 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.085 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.5 m -84.12 124.83 40.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.111 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -109.47 102.47 11.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.904 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.0 mt -113.67 167.99 10.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.136 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.429 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 5.5 ttt-85 -144.4 97.6 3.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.702 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -55.69 171.28 0.22 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.423 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.42 -30.54 13.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.029 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -105.97 164.83 11.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.893 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -79.98 -65.31 1.02 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.958 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -60.04 -26.79 66.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.151 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 4.5 t -68.96 -43.49 74.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.908 0.385 . . . . 0.0 110.282 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -73.31 -28.23 61.97 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.544 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 11.1 ptt85 -79.28 -40.48 30.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.429 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.3 t -70.95 -31.76 68.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.108 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 9.9 m95 -71.51 -47.4 55.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.854 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . 0.412 ' O ' HG13 ' A' ' 130' ' ' VAL . . . -58.17 -48.95 78.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.263 0.554 . . . . 0.0 110.465 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.45 -42.48 95.85 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.581 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.89 -40.76 75.47 Favored 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 120.854 -0.338 . . . . 0.0 110.746 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . . . . . . . . . 11.8 mt -61.11 -23.12 28.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 177.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.472 ' N ' HG13 ' A' ' 130' ' ' VAL . 1.2 tt0 -77.74 -42.1 35.41 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.618 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.82 -43.68 92.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.487 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 74.6 mm-40 -67.28 -37.23 83.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.074 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.8 -33.27 51.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.694 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 124.84 54.29 0.18 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.593 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 4.7 t . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.072 179.992 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.823 0.344 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.6 p -99.1 114.32 26.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.852 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.93 82.41 1.68 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.499 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -163.49 96.25 0.85 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.783 0.325 . . . . 0.0 110.839 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.73 98.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.817 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.36 112.58 5.39 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.116 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -67.31 160.64 46.74 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.399 2.066 . . . . 0.0 112.309 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -110.61 144.85 38.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.739 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.2 p -133.32 164.03 28.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -158.08 118.64 0.84 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.338 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 17.8 mt -59.44 93.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.843 0.354 . . . . 0.0 110.913 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -96.32 170.04 9.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.787 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -110.94 146.93 35.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.964 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 14.6 tp -125.37 142.99 51.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.738 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.479 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER -69.44 170.58 10.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.697 -179.837 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -170.26 34.75 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.897 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -111.03 166.81 12.33 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.501 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -134.68 39.07 3.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.807 0.337 . . . . 0.0 111.098 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.04 174.77 29.4 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.482 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.4 m -127.45 132.4 50.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.841 0.353 . . . . 0.0 110.871 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.15 23.71 5.99 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.589 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 56.2 -168.67 0.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.84 0.353 . . . . 0.0 111.183 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 136.15 -53.49 0.76 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.462 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -174.73 53.41 0.13 Allowed Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.492 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -59.79 150.38 28.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.869 0.366 . . . . 0.0 110.917 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -109.12 46.63 0.97 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.952 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.479 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 12.1 m95 -54.26 91.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.904 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -65.95 178.97 0.97 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.136 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 tmm_? -117.92 110.82 18.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.824 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 29.0 m -113.96 138.44 43.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.157 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.0 tp -83.69 127.42 33.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.561 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 mp -98.16 101.28 12.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.119 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.45 94.03 9.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.648 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 tp -87.69 129.81 35.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.992 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -135.72 140.07 44.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.972 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.7 -23.09 49.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.072 0.463 . . . . 0.0 111.251 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -86.47 -30.85 21.71 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.93 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -178.16 -178.66 0.67 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.99 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.37 157.6 21.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.922 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.413 HG21 ' CD2' ' A' ' 122' ' ' HIS . 24.7 m -158.24 128.02 5.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.626 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 10.7 t -119.78 157.97 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.012 0.434 . . . . 0.0 111.348 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.5 t -160.1 157.57 25.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.406 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo -73.85 39.56 0.52 Allowed 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.732 2.288 . . . . 0.0 112.973 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 44.98 29.56 0.48 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.018 0.437 . . . . 0.0 111.404 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -115.64 172.63 7.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.884 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -91.44 81.16 1.26 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.468 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -61.81 154.12 68.7 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.807 0.337 . . . . 0.0 110.908 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.67 165.34 27.89 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.513 2.142 . . . . 0.0 112.314 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -117.38 -147.8 8.61 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.485 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -68.9 -27.8 30.32 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.648 2.232 . . . . 0.0 112.264 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -145.89 91.36 5.62 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.964 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.01 -167.66 0.17 Allowed 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 122.546 2.164 . . . . 0.0 112.338 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -138.26 107.8 8.01 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.884 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -50.83 141.06 36.85 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.487 2.125 . . . . 0.0 112.387 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -99.92 -177.76 3.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.197 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.6 110.48 20.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.849 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 5.6 mt -74.48 -50.57 17.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 68.86 -67.51 0.21 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.999 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -170.57 -132.22 1.44 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.474 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . 59.93 168.83 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.827 0.346 . . . . 0.0 111.124 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.88 -175.56 0.31 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.081 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -144.53 142.08 18.79 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.915 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -73.78 164.74 33.95 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.535 2.157 . . . . 0.0 112.335 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 172.56 62.17 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.531 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.89 145.59 55.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 0.0 111.064 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -91.92 148.72 37.56 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.095 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.487 ' N ' ' CD ' ' A' ' 68' ' ' PRO . 31.7 Cg_exo -56.99 -46.23 30.53 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.46 2.107 . . . . 0.0 112.802 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 67' ' ' PRO . 94.3 Cg_endo -82.35 -169.66 0.79 Allowed 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.891 2.394 . . . . 0.0 112.371 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 61.66 152.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.9 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.61 121.88 51.4 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.733 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.31 -156.42 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.447 2.098 . . . . 0.0 112.262 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 65.38 72.1 0.43 Allowed 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.516 0.674 . . . . 0.0 110.543 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -177.96 -43.08 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.813 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.8 mp -100.4 6.49 44.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.28 178.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.44 -37.41 4.66 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.535 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.404 ' CD1' ' N ' ' A' ' 77' ' ' GLN . 0.1 OUTLIER -87.23 -51.0 6.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.652 179.999 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.404 ' N ' ' CD1' ' A' ' 76' ' ' LEU . 0.8 OUTLIER -67.1 127.02 31.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 179.977 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.77 -60.76 0.33 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.851 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -97.38 36.75 1.43 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.937 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.3 t -112.5 -50.86 5.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.116 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.6 t -89.39 142.9 30.05 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.947 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.07 59.03 6.38 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.579 2.186 . . . . 0.0 112.426 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -176.29 38.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.859 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -147.42 97.4 2.85 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.87 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -132.2 126.09 32.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.921 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -141.35 114.83 8.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.904 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 63.58 125.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.896 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 60.93 165.36 0.08 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.102 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 102.42 -53.1 0.79 Allowed Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.51 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -158.49 70.74 0.25 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.547 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 70.0 p -95.56 154.66 17.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 110.902 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.63 21.72 1.65 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.111 0.482 . . . . 0.0 111.081 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.2 p -78.19 157.05 5.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.044 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -176.14 -38.3 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.528 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 -119.82 72.51 0.93 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.944 0.402 . . . . 0.0 110.898 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.64 45.05 1.61 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.943 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.8 m -130.52 142.99 47.47 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.938 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.419 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 51.4 Cg_exo -54.4 130.07 38.0 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.434 2.089 . . . . 0.0 112.208 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 98' ' ' PRO . 16.1 Cg_exo -67.85 -27.25 37.51 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.444 2.096 . . . . 0.0 111.899 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -144.31 146.17 32.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.041 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -176.72 86.05 0.26 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.842 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.54 61.96 3.6 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.574 2.182 . . . . 0.0 112.239 179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -115.49 124.68 51.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.891 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -88.7 -38.75 14.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.91 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -70.89 178.66 3.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.812 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.18 146.65 34.33 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.854 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.26 173.19 13.43 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.483 2.122 . . . . 0.0 112.328 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.58 111.25 13.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.836 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.9 m -137.84 89.1 15.36 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.917 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.22 146.82 64.79 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.555 2.17 . . . . 0.0 112.313 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -79.06 152.6 36.73 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.483 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.69 148.85 26.65 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.621 2.214 . . . . 0.0 112.268 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -128.24 139.21 34.81 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.909 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.28 90.69 1.17 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.575 2.183 . . . . 0.0 112.339 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.3 mtp180 -94.64 164.94 12.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.916 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -139.55 -48.78 0.48 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.929 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 4.2 pp -135.17 136.47 41.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.888 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.5 -32.61 12.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.008 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -87.69 121.14 29.75 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.878 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.09 -177.71 1.76 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.071 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 18.1 mttm -121.07 108.86 14.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.897 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.413 ' CD2' HG21 ' A' ' 40' ' ' THR . 14.1 m80 -109.92 144.63 38.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.949 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 4.0 t -123.39 127.32 74.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.869 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 56.4 p -58.27 -30.19 66.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.231 -179.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.1 mp 65.05 31.01 11.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.928 0.394 . . . . 0.0 110.832 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.18 36.12 3.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.716 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.5 mtp 170.01 -28.85 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.896 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -51.32 -177.86 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.976 0.417 . . . . 0.0 111.574 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -165.08 115.97 1.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.514 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.474 HG13 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -89.66 158.61 2.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.287 0.565 . . . . 0.0 111.487 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -167.92 128.08 1.34 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.707 -179.947 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.27 112.21 24.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.083 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -90.77 174.25 7.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.762 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 1.2 m -105.64 163.47 12.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.015 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.428 HG22 ' CZ ' ' A' ' 143' ' ' TYR . 1.7 m -127.41 116.68 21.41 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.815 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -54.18 -39.29 86.82 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.48 2.12 . . . . 0.0 112.35 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.92 -32.79 34.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.096 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -127.03 75.34 76.62 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.838 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -59.67 -23.73 72.7 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.673 2.248 . . . . 0.0 112.572 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.453 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.8 OUTLIER -67.41 -64.49 2.03 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.2 -179.701 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.453 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 66.8 Cg_endo -73.7 130.15 14.37 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.4 2.066 . . . . 0.0 112.442 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.05 121.83 38.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.762 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.428 ' CZ ' HG22 ' A' ' 135' ' ' THR . 4.9 m-85 -57.33 112.93 1.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.989 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.1 mt -83.32 88.93 6.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.878 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -96.51 137.81 35.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.965 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 25.2 mt -141.46 126.76 18.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.035 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 63.8 m -114.22 130.6 56.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.049 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -112.15 152.03 28.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.103 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.87 30.96 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.356 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -111.03 42.41 1.64 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.336 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.22 26.79 1.96 Allowed Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.354 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 57.59 59.24 3.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.106 0.479 . . . . 0.0 111.006 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -90.13 152.3 21.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.774 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.13 94.23 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.056 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 10.8 m -95.76 132.98 38.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.169 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.449 ' CD1' ' N ' ' A' ' 156' ' ' PHE . 0.7 OUTLIER -119.06 98.77 6.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.897 179.918 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.02 167.92 9.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.937 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' ARG . . . . . 0.427 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.9 OUTLIER -129.46 107.34 9.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.776 179.976 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.39 173.45 0.51 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.15 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.23 -30.14 16.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.039 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -122.53 157.78 31.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.929 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.09 -42.62 69.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.062 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.7 76.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.98 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 60.4 p -63.9 -44.26 93.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.653 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -62.84 -43.86 97.68 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.923 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.67 -42.4 77.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.484 179.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 91.1 p -66.57 -34.67 78.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.2 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' TRP . . . . . . . . . . . . . 12.1 m95 -73.0 -50.13 24.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.785 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . 0.404 ' O ' HG13 ' A' ' 130' ' ' VAL . . . -56.31 -51.13 69.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.271 0.557 . . . . 0.0 110.592 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.73 -41.31 95.79 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.71 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.41 -41.33 80.6 Favored 'General case' 0 CA--C 1.511 -0.544 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.141 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.433 HG23 ' HB ' ' A' ' 130' ' ' VAL . 7.0 mt -62.41 -23.38 32.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . 0.474 ' N ' HG13 ' A' ' 130' ' ' VAL . 0.4 OUTLIER -79.97 -30.73 39.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.353 179.286 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -66.36 -47.03 74.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.423 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -71.05 -37.02 72.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.234 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 176' ' ' ILE . . . . . 0.401 HD12 ' CG2' ' A' ' 172' ' ' ILE . 70.3 mt -83.33 -5.95 9.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.373 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -88.12 27.42 6.81 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.321 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.911 -179.939 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo . . . . . 0 N--CA 1.466 -0.134 0 CA-C-O 120.74 0.225 . . . . 0.0 112.281 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.5 ttm-85 -82.56 130.25 35.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.559 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.805 HG22 ' HA ' ' A' ' 33' ' ' SER . 21.7 p -120.65 146.37 46.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.971 0.415 . . . . 0.0 111.224 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -134.73 127.69 4.54 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.465 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' A' ' 11' ' ' LEU . 8.1 mt -69.82 101.24 1.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.944 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.812 HD13 HD22 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -121.23 164.2 17.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.717 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.688 ' O ' HD23 ' A' ' 157' ' ' LEU . 0.9 OUTLIER -89.55 163.79 15.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.959 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.452 ' HB2' HG21 ' A' ' 30' ' ' VAL . 18.1 tp -137.53 124.67 21.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.665 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.48 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 33.8 ttt180 . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.657 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.48 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.4 m95 . . . . . 0 CA--C 1.528 0.098 0 CA-C-O 120.807 0.336 . . . . 0.0 111.167 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -166.63 141.61 4.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -64.2 136.04 56.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.007 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.452 HG21 ' HB2' ' A' ' 14' ' ' LEU . 31.6 m -146.36 169.98 5.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.12 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.478 HD23 ' HA ' ' A' ' 31' ' ' LEU . 0.7 OUTLIER -107.17 141.62 38.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.725 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 1.117 HD21 HD13 ' A' ' 157' ' ' LEU . 9.9 mp -114.54 82.84 1.79 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.901 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.805 ' HA ' HG22 ' A' ' 9' ' ' THR . 1.0 OUTLIER -69.95 88.9 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.58 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.109 HD12 HD23 ' A' ' 39' ' ' LEU . 1.7 tp -87.73 119.18 27.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.236 -179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -109.79 156.07 20.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.815 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -49.9 -22.82 1.64 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.793 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.444 ' HA ' HD12 ' A' ' 125' ' ' LEU . 3.6 p30 -152.87 38.14 0.51 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.204 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.564 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -175.2 119.92 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.957 0.408 . . . . 0.0 111.646 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 1.109 HD23 HD12 ' A' ' 34' ' ' LEU . 3.0 tm? -104.16 100.88 10.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.496 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.412 ' HG1' ' CE1' ' A' ' 122' ' ' HIS . 85.5 m -109.78 126.75 54.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.369 -179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.603 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 11.5 t -94.56 158.57 2.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.391 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.417 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -149.52 166.4 15.33 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.904 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -82.6 50.72 3.49 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.658 2.238 . . . . 0.0 112.46 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.188 -179.867 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.603 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 120.85 0.357 . . . . 0.0 111.084 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.59 82.8 2.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.928 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.412 ' CE1' ' HG1' ' A' ' 40' ' ' THR . 14.5 m-70 -76.18 135.62 39.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.829 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.558 HG11 ' HB2' ' A' ' 148' ' ' ALA . 21.5 t -138.62 120.77 17.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.116 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 5.6 m -59.69 151.38 25.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.858 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 37' ' ' ASP . 59.7 mt -109.32 38.08 2.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.899 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.93 34.23 4.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.833 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.561 ' HB2' ' HB3' ' A' ' 149' ' ' ALA . 10.5 ptt? 179.3 -36.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.044 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.85 -176.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.379 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.699 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.0 OUTLIER -167.44 125.79 1.28 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.472 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.586 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.2 p -94.19 159.18 2.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 121.255 0.55 . . . . 0.0 111.406 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' HG22 ' A' ' 130' ' ' VAL . 34.4 p -157.85 134.89 10.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.86 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 9.8 ttm105 -96.15 95.64 8.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.874 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.95 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.858 0.361 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.564 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.2 OUTLIER -121.0 140.55 51.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.794 179.892 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 145' ' ' GLU . . . . . 0.435 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 6.0 tm-20 -148.68 126.49 11.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.826 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.782 HD11 HD13 ' A' ' 172' ' ' ILE . 29.6 mt -126.41 118.51 51.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.161 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 7.8 m -99.56 138.15 37.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.814 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.626 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -114.24 149.07 36.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.219 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.561 ' HB3' ' HB2' ' A' ' 127' ' ' MET . . . -95.14 30.4 2.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.286 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -115.23 45.03 1.71 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.186 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.3 22.73 3.37 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.132 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 58.1 61.06 2.45 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.17 0.51 . . . . 0.0 110.968 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.626 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.1 m-20 -87.43 157.67 19.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.911 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -156.47 90.93 1.2 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.119 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 7.3 m -84.61 118.66 32.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.233 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.435 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 70.2 m-85 -106.18 116.19 31.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.749 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 1.117 HD13 HD21 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -127.18 160.58 30.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.03 -179.742 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.457 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 5.2 tmm_? -135.78 94.11 3.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.811 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 1.023 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -54.92 172.35 0.11 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.366 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.07 -32.66 11.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.885 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -98.32 162.39 13.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.931 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.46 -51.64 6.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.955 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -69.07 -30.62 68.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 20.2 m -67.66 -52.84 33.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.652 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 1.023 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -61.34 -35.83 78.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.976 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -43.62 54.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.491 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 5.1 m -67.75 -30.15 69.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.046 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.575 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 5.4 m95 -71.28 -50.95 27.35 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.972 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.564 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -56.09 -51.52 67.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.325 0.583 . . . . 0.0 110.575 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -56.81 -41.03 90.63 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.58 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.21 -40.58 77.91 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.842 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.787 HG22 HD12 ' A' ' 176' ' ' ILE . 18.3 mt -60.07 -24.68 30.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.586 ' N ' HG11 ' A' ' 130' ' ' VAL . 4.2 tt0 -82.52 -28.35 31.14 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.255 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.11 -49.67 69.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.116 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -68.74 -41.07 79.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.75 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.787 HD12 HG22 ' A' ' 172' ' ' ILE . 91.7 mt -76.79 -7.55 10.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.282 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.481 179.85 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo . . . . . 0 C--O 1.23 0.124 0 CA-C-O 120.889 0.287 . . . . 0.0 112.284 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -79.39 141.04 37.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.775 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.8 p -139.17 138.8 37.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.058 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -146.18 127.25 2.72 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.418 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.2 mt -59.03 103.99 0.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.775 0.322 . . . . 0.0 110.985 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.467 HD22 ' CB ' ' A' ' 157' ' ' LEU . 0.1 OUTLIER -103.2 170.13 8.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.723 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -114.66 151.64 33.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.003 0.43 . . . . 0.0 111.123 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.408 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 1.2 tp -137.48 142.38 41.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.407 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.583 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 120.887 0.375 . . . . 0.0 110.891 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.583 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 12.8 m95 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.783 0.325 . . . . 0.0 110.829 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.85 179.11 6.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.907 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.4 ttp180 -112.32 133.41 54.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.895 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.85 HG12 ' HA ' ' A' ' 43' ' ' PRO . 27.7 m -139.54 120.91 15.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.206 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.9 tp -71.53 128.99 37.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.596 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.423 HD12 HG13 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -95.27 132.16 40.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.026 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -108.97 84.97 2.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.778 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.3 tp -82.0 108.88 15.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.997 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.58 146.39 44.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.022 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -61.5 -16.24 45.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.485 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -95.3 -25.51 16.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.994 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.437 ' HA ' HD22 ' A' ' 125' ' ' LEU . . . -179.07 178.52 0.73 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.917 0.389 . . . . 0.0 111.089 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.533 ' HB2' HD13 ' A' ' 125' ' ' LEU . 0.2 OUTLIER -123.07 113.12 18.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.801 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 56.5 m -116.8 134.16 55.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.942 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.474 HG12 ' N ' ' A' ' 42' ' ' SER . 11.1 t -115.8 159.77 15.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.17 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.474 ' N ' HG12 ' A' ' 41' ' ' VAL . 6.2 t -155.56 157.8 31.67 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.553 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.85 ' HA ' HG12 ' A' ' 30' ' ' VAL . 3.1 Cg_exo -75.24 44.43 1.2 Allowed 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.943 2.429 . . . . 0.0 112.725 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.152 0 CA-C-O 120.917 0.389 . . . . 0.0 111.348 179.838 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.059 0 CA-C-O 120.871 0.367 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.56 88.64 2.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.922 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 14.8 m-70 -85.8 139.53 31.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.062 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.47 HG12 ' H ' ' A' ' 125' ' ' LEU . 11.2 t -122.87 120.87 61.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.882 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.99 -28.31 16.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.317 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.533 HD13 ' HB2' ' A' ' 39' ' ' LEU . 1.2 tp 62.69 -174.38 0.15 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.754 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt 57.54 37.2 27.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.835 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.72 ' HG2' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -178.99 -36.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.925 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.631 ' HB3' HG13 ' A' ' 176' ' ' ILE . . . -56.08 -169.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.071 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.4 ' HA ' HG21 ' A' ' 176' ' ' ILE . 13.1 t80 -161.89 116.56 1.93 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.956 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.589 HG11 ' C ' ' A' ' 172' ' ' ILE . 1.4 p -97.08 158.69 3.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.184 0.516 . . . . 0.0 111.154 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.2 m -163.88 156.41 17.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.84 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 19.7 ttp-105 -122.54 93.67 4.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.978 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.72 179.826 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.405 ' CE1' ' HD2' ' A' ' 158' ' ' ARG . 3.4 m-30 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.759 0.314 . . . . 0.0 110.937 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.808 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.5 OUTLIER -90.33 98.75 11.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.655 179.862 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 145' ' ' GLU . . . . . 0.401 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 8.3 tm-20 -102.74 132.09 49.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.976 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.514 HG12 HG21 ' A' ' 172' ' ' ILE . 5.1 mp -135.74 111.58 12.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.906 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.5 m -100.6 134.09 44.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.873 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.754 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -108.11 145.31 34.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.283 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.72 ' HB3' ' HG2' ' A' ' 127' ' ' MET . . . -96.56 31.55 2.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.104 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -125.35 50.1 1.83 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.283 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 126.13 14.61 2.98 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.663 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 61.06 62.93 1.33 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.063 0.459 . . . . 0.0 110.896 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.754 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 81.0 m-20 -92.15 151.84 20.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.758 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 154' ' ' ALA . . . . . 0.447 ' HB1' ' CE1' ' A' ' 156' ' ' PHE . . . -157.8 91.81 1.16 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.069 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 155' ' ' VAL . 14.0 m -94.36 115.73 33.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.301 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.447 ' CE1' ' HB1' ' A' ' 154' ' ' ALA . 8.8 m-85 -105.21 89.59 3.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.554 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.467 ' CB ' HD22 ' A' ' 12' ' ' LEU . 1.1 mt -104.88 167.96 9.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.302 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.469 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 14.7 ttt-85 -127.43 103.16 7.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.616 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.909 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.01 173.57 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.294 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -77.49 -69.54 0.53 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.068 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -110.25 177.6 4.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.04 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.85 -42.65 66.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.011 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -63.75 -50.86 67.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.982 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -46.58 88.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.591 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.909 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -61.29 -37.4 83.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.962 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.4 -47.9 58.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.443 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 56.3 m -64.7 -33.1 75.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.067 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.456 ' O ' HD12 ' A' ' 172' ' ' ILE . 11.7 m95 -73.61 -50.8 19.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.712 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.808 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -57.15 -46.48 82.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.286 0.565 . . . . 0.0 110.474 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -60.49 -43.09 99.18 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.768 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.82 -40.37 72.48 Favored 'General case' 0 CA--C 1.509 -0.615 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.805 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.765 ' O ' HD13 ' A' ' 176' ' ' ILE . 11.8 mt -60.95 -23.73 30.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.561 ' N ' HG11 ' A' ' 130' ' ' VAL . 17.7 tt0 -78.87 -40.69 31.78 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.481 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.5 -46.18 84.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.43 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.07 -39.01 89.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.023 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.765 HD13 ' O ' ' A' ' 172' ' ' ILE . 1.2 mp -60.07 -36.05 65.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.592 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.46 -179.914 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo . . . . . 0 C--O 1.231 0.154 0 CA-C-O 120.771 0.238 . . . . 0.0 112.386 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -85.41 140.91 30.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.634 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.727 HG22 ' HA ' ' A' ' 33' ' ' SER . 70.4 p -137.24 147.28 45.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.849 0.357 . . . . 0.0 111.191 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -152.55 123.16 1.41 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.356 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 35.0 mt -56.39 102.87 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.829 0.347 . . . . 0.0 111.03 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.872 HD13 HD22 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -112.63 151.65 29.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.716 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -95.23 146.58 24.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.873 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.447 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 14.8 tp -125.03 142.94 51.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.45 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.481 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 19.1 ttp180 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.576 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.481 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.8 m95 . . . . . 0 N--CA 1.462 0.132 0 CA-C-O 120.8 0.333 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -97.97 178.65 5.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.983 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.4 HH11 ' HB1' ' A' ' 44' ' ' ALA . 2.0 tmm_? -105.94 129.95 53.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.845 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.733 HG12 ' HA ' ' A' ' 43' ' ' PRO . 32.6 m -144.46 123.51 6.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.358 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.5 tp -69.72 120.96 16.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.503 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 1.009 HD12 HG13 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -88.12 109.2 19.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.962 -179.929 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.727 ' HA ' HG22 ' A' ' 9' ' ' THR . 44.1 t -85.01 84.43 7.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.688 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.673 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 4.1 tp -78.74 125.9 30.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.306 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -129.95 141.65 50.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.928 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -63.03 -14.8 52.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.52 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -101.8 -19.89 15.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.108 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.518 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -173.5 172.08 3.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.878 0.37 . . . . 0.0 111.068 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.451 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -121.66 107.86 12.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.809 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -113.69 141.4 47.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.155 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 1.009 HG13 HD12 ' A' ' 32' ' ' LEU . 2.5 t -118.41 152.92 20.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.012 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.4 t -149.05 149.93 31.02 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.541 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.733 ' HA ' HG12 ' A' ' 30' ' ' VAL . 60.4 Cg_endo -72.69 47.5 1.19 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.582 2.188 . . . . 0.0 112.838 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.4 ' HB1' HH11 ' A' ' 29' ' ' ARG . . . . . . . . 0 C--N 1.333 -0.134 0 CA-C-O 120.9 0.381 . . . . 0.0 111.408 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.795 0.331 . . . . 0.0 110.995 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.506 ' HE2' HG12 ' A' ' 155' ' ' VAL . 6.3 mttp -131.79 82.99 2.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.009 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -82.49 150.87 26.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.961 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.497 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 18.7 t -150.37 159.34 4.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.022 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.499 ' O ' HD22 ' A' ' 125' ' ' LEU . 0.7 OUTLIER -82.2 171.54 14.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.048 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.518 HD23 ' HA ' ' A' ' 38' ' ' ALA . 0.7 OUTLIER -134.63 31.54 3.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.825 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.82 41.91 0.94 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.909 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.5 ttm 178.89 -36.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.939 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.12 -165.96 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.251 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.479 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.1 OUTLIER -168.61 137.76 2.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.66 -179.979 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.623 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -110.25 158.89 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.314 0.578 . . . . 0.0 111.484 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.3 m -163.67 151.43 12.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.473 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 11.8 ptt-85 -123.57 91.76 3.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.879 0.371 . . . . 0.0 111.171 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.703 179.653 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.802 0.334 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.565 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.4 OUTLIER -76.29 105.07 7.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.891 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 145' ' ' GLU . . . . . 0.425 ' HG3' ' CZ ' ' A' ' 156' ' ' PHE . 0.1 OUTLIER -111.0 130.66 55.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.629 HD11 ' CD1' ' A' ' 172' ' ' ILE . 24.5 mt -129.98 115.63 34.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.075 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 2.9 m -95.2 136.7 35.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.953 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.574 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -116.83 148.58 41.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.175 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.59 30.55 1.98 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.357 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.27 44.51 1.68 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.114 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 118.84 22.2 3.66 Favored Glycine 0 N--CA 1.452 -0.282 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.107 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 58.89 62.05 1.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.123 0.487 . . . . 0.0 110.818 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.574 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 1.2 m-20 -90.63 162.27 15.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.882 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.21 94.21 0.81 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.069 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.506 HG12 ' HE2' ' A' ' 121' ' ' LYS . 32.9 m -87.07 120.23 36.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.328 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.425 ' CZ ' ' HG3' ' A' ' 145' ' ' GLU . 0.3 OUTLIER -104.18 90.03 3.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.75 179.868 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.482 ' CB ' HD22 ' A' ' 12' ' ' LEU . 1.2 mt -102.75 168.96 8.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.961 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 158' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -137.44 103.35 5.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.838 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 1.054 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -57.53 173.49 0.27 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.5 tttp -79.86 -71.41 0.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.989 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -85.08 170.89 12.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.873 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -81.04 -35.56 31.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.948 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -73.33 -40.14 64.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.953 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.11 -41.4 90.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.43 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 1.054 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -64.76 -42.97 94.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.767 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.9 mtt180 -70.43 -43.97 68.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.225 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -34.53 77.84 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.327 0.584 . . . . 0.0 109.502 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.673 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -68.68 -59.83 2.84 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.595 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.565 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -47.13 -57.61 4.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.161 0.505 . . . . 0.0 110.881 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.46 -39.0 58.97 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.438 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -67.66 -41.61 83.51 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.152 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.927 HG22 HD12 ' A' ' 176' ' ' ILE . 12.7 mt -62.0 -23.29 31.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 177.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.623 ' N ' HG11 ' A' ' 130' ' ' VAL . 7.0 tt0 -81.17 -28.55 34.95 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.265 179.365 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.92 -45.12 75.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.375 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 175' ' ' GLN . . . . . 0.441 ' HB2' HD11 ' A' ' 125' ' ' LEU . 18.7 mt-30 -74.87 -34.44 62.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.188 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.927 HD12 HG22 ' A' ' 172' ' ' ILE . 82.8 mt -85.77 -7.36 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.33 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.362 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.515 179.916 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo . . . . . 0 C--O 1.231 0.146 0 CA-C-O 120.847 0.27 . . . . 0.0 112.272 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -84.15 152.53 24.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.943 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.756 HG22 ' HA ' ' A' ' 33' ' ' SER . 70.7 p -142.55 142.91 32.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.95 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -150.75 132.0 3.75 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.415 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.71 HD22 ' HD3' ' A' ' 29' ' ' ARG . 11.4 mt -64.84 119.45 10.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.871 0.367 . . . . 0.0 111.04 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 157' ' ' LEU . 0.1 OUTLIER -134.33 158.8 42.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.787 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.63 ' O ' HD23 ' A' ' 157' ' ' LEU . 1.4 mm-40 -92.5 157.75 16.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.969 0.414 . . . . 0.0 110.985 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.4 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 14.3 tp -134.81 130.29 35.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.659 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.488 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 12.9 ttp180 . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.655 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.488 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.7 m95 . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.653 0.263 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -169.28 166.78 10.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.875 0.369 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.71 ' HD3' HD22 ' A' ' 11' ' ' LEU . 7.6 tmm_? -90.81 130.5 36.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.853 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.713 HG12 ' HA ' ' A' ' 43' ' ' PRO . 34.6 m -149.93 125.13 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.367 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 tp -69.8 135.1 49.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.625 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.552 ' HG ' HG22 ' A' ' 41' ' ' VAL . 1.3 mp -103.93 113.97 27.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.964 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.756 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.9 OUTLIER -86.71 81.14 8.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.766 179.861 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.63 HD12 HD21 ' A' ' 39' ' ' LEU . 3.6 tp -73.7 117.08 15.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.105 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.434 ' O ' HD22 ' A' ' 125' ' ' LEU . . . -121.97 138.95 54.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.964 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.88 -23.9 47.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.222 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.33 -31.93 22.74 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.975 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.428 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -172.67 174.22 3.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.205 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.63 HD21 HD12 ' A' ' 34' ' ' LEU . 1.2 mt -111.26 115.32 29.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.864 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 63.9 m -120.27 130.74 54.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.841 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.641 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 14.7 t -111.86 159.34 11.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.169 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.473 ' N ' HG12 ' A' ' 41' ' ' VAL . 6.0 t -155.65 153.34 26.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.495 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.713 ' HA ' HG12 ' A' ' 30' ' ' VAL . 13.7 Cg_exo -69.41 50.68 0.73 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.736 2.291 . . . . 0.0 112.695 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.143 0 CA-C-O 120.875 0.369 . . . . 0.0 111.438 179.893 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.641 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 C--O 1.23 0.05 0 CA-C-O 120.814 0.34 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.32 159.74 15.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.802 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -147.67 135.28 20.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.881 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.756 HG13 ' HB2' ' A' ' 148' ' ' ALA . 19.7 t -139.68 140.15 37.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.135 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.01 135.74 37.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.832 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.434 HD22 ' O ' ' A' ' 35' ' ' ALA . 3.2 mp -99.19 31.49 3.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.864 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -139.41 38.12 2.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.739 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.737 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 2.3 mtt 179.27 -35.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.063 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.8 -165.97 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.322 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -170.04 113.67 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.665 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.576 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.0 p -88.14 158.8 3.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.322 0.582 . . . . 0.0 111.439 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 2.6 m -164.65 149.78 9.84 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.801 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 7.0 ptt85 -126.67 104.04 7.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.012 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.753 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.458 -0.055 0 CA-C-O 120.88 0.371 . . . . 0.0 110.949 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.469 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.8 OUTLIER -82.83 138.1 34.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.949 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 145' ' ' GLU . . . . . 0.416 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.0 OUTLIER -153.66 139.91 18.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.82 179.952 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 24.9 mt -134.1 125.1 47.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.241 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.47 126.18 49.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.78 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.857 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -102.78 145.53 29.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.361 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.737 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -96.75 30.65 2.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.171 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -118.61 46.07 1.91 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.38 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.39 23.11 2.69 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.356 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 58.43 60.66 2.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.126 0.489 . . . . 0.0 110.94 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.857 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 0.6 OUTLIER -90.16 160.65 16.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.9 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.23 94.03 0.8 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.078 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 6.9 m -89.48 112.67 24.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.246 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.416 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 15.6 m-85 -97.2 115.99 28.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.731 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.63 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.4 mt -125.66 165.61 18.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.078 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.459 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.1 OUTLIER -140.43 96.81 3.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.748 179.863 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.951 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -57.33 162.88 2.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.203 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.98 -32.23 17.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.924 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -98.13 164.27 12.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.822 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -88.65 -55.8 3.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.91 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.81 85.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.159 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 1.8 t -63.97 -48.16 77.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.79 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.951 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -60.12 -38.61 83.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.011 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 74.3 mtp180 -71.12 -47.33 58.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.436 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.06 -28.4 69.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.176 179.237 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.6 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -72.44 -52.07 17.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.908 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.469 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -56.9 -47.62 80.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.304 0.573 . . . . 0.0 110.53 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.96 -43.12 97.04 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.64 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.95 -40.72 78.76 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.997 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.795 HG22 HD12 ' A' ' 176' ' ' ILE . 19.1 mt -60.21 -24.63 31.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.576 ' N ' HG11 ' A' ' 130' ' ' VAL . 30.6 tt0 -83.84 -27.0 29.03 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.324 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.56 -47.98 68.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.141 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -69.96 -42.09 73.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.86 179.038 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.795 HD12 HG22 ' A' ' 172' ' ' ILE . 75.9 mt -77.57 -8.94 12.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.36 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.361 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.393 179.847 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo . . . . . 0 C--O 1.23 0.122 0 CA-C-O 120.84 0.267 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.647 ' CG ' HD23 ' A' ' 34' ' ' LEU . 4.4 ptt180 -101.25 139.18 37.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.952 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.628 HG22 ' HA ' ' A' ' 33' ' ' SER . 14.0 p -129.36 167.98 16.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.02 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -167.05 132.75 2.7 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.48 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.5 103.22 0.63 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.762 0.315 . . . . 0.0 110.895 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -120.19 146.69 45.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.811 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.492 ' O ' HD23 ' A' ' 157' ' ' LEU . 4.1 mm-40 -70.64 169.84 13.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.922 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.422 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 37.6 tp -157.57 130.42 7.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.697 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.483 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.635 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.483 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 17.1 m95 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.726 0.298 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -178.09 168.45 1.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.926 0.393 . . . . 0.0 110.844 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -95.09 129.02 42.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.866 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 27.7 m -136.65 138.39 46.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.177 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 17.4 tp -74.33 123.44 24.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.658 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.776 HD12 HG13 ' A' ' 41' ' ' VAL . 0.4 OUTLIER -98.04 114.49 26.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.108 -179.833 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.628 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.9 OUTLIER -94.47 85.74 4.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.575 179.657 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.732 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 2.5 tp -84.93 103.7 14.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.136 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.639 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -91.21 155.96 18.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.706 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -57.43 -16.73 10.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.816 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.06 28.95 1.1 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.432 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.69 ' CA ' HD23 ' A' ' 125' ' ' LEU . . . 179.55 114.75 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.858 0.361 . . . . 0.0 111.514 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.543 HD13 HD12 ' A' ' 34' ' ' LEU . 17.2 tp -95.92 82.44 3.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.397 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.489 HG21 ' CE1' ' A' ' 122' ' ' HIS . 27.6 m -92.49 114.19 26.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.204 -179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.776 HG13 HD12 ' A' ' 32' ' ' LEU . 8.0 t -83.41 157.35 3.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.675 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.411 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -159.9 163.09 23.42 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.906 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.35 147.41 59.0 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.534 2.156 . . . . 0.0 112.133 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.984 179.905 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.488 ' HB3' ' NE2' ' A' ' 122' ' ' HIS . . . . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.845 0.355 . . . . 0.0 111.224 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.431 ' HB2' HG23 ' A' ' 41' ' ' VAL . 2.0 mtpp -110.41 74.53 0.88 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.049 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.489 ' CE1' HG21 ' A' ' 40' ' ' THR . 19.6 m-70 -73.05 102.7 3.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.975 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.763 HG13 ' HB2' ' A' ' 148' ' ' ALA . 24.7 t -99.94 115.65 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.965 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 72.1 p -59.74 137.44 58.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.848 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.69 HD23 ' CA ' ' A' ' 38' ' ' ALA . 4.0 mm? -98.64 53.96 1.03 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.807 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 27.1 mttt -164.45 37.3 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.006 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.713 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -178.51 -39.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.38 . . . . 0.0 110.949 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.15 -169.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.149 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.675 ' HA ' HG21 ' A' ' 176' ' ' ILE . 13.6 t80 -170.11 123.48 0.71 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.495 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.569 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.5 p -94.66 157.65 3.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.492 0.663 . . . . 0.0 111.615 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.479 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -170.31 127.67 0.83 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.696 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 18.3 ptt-85 -83.26 96.49 8.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.947 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 30.3 mtt180 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.034 -179.751 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 . . . . . 0 N--CA 1.456 -0.153 0 CA-C-O 120.842 0.353 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.544 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 2.0 mt -69.94 94.02 0.82 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.97 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -99.9 123.67 44.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.78 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.484 HD11 HD13 ' A' ' 172' ' ' ILE . 22.5 mt -128.81 120.8 53.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.212 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -101.91 129.74 48.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.775 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.763 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -110.98 146.46 36.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.192 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.713 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.1 30.84 2.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.283 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -114.95 44.92 1.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.062 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.93 20.93 3.3 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.692 -0.686 . . . . 0.0 112.249 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 58.69 61.33 2.23 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.066 0.46 . . . . 0.0 110.949 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.604 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.4 m-20 -92.85 157.96 16.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.682 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -161.15 92.78 0.93 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.225 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.8 m -84.49 127.17 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.032 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -109.21 88.72 2.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.742 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.492 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.5 mt -95.95 153.57 17.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.901 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.457 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER -127.83 94.02 3.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.841 -179.893 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.992 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -58.24 143.53 44.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.123 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.07 -32.95 51.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.816 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.12 168.6 10.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.848 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -88.72 -61.3 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.878 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -59.7 -31.96 70.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.075 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -49.82 70.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.745 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.992 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -60.44 -41.87 94.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.183 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -71.33 -40.38 70.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.545 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 94.4 p -68.59 -33.89 74.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.097 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.732 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -74.28 -49.1 24.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.839 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.544 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -58.57 -49.76 76.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.328 0.585 . . . . 0.0 110.278 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.65 -42.02 96.0 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.425 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.18 -40.68 77.96 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.77 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.718 HG22 HD12 ' A' ' 176' ' ' ILE . 11.2 mt -60.33 -24.43 30.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.569 ' N ' HG11 ' A' ' 130' ' ' VAL . 6.3 tp60 -81.43 -29.88 33.7 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.008 -0.997 . . . . 0.0 110.069 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.79 -49.8 71.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.119 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.24 -42.14 84.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.713 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.718 HD12 HG22 ' A' ' 172' ' ' ILE . 80.5 mt -76.83 -5.55 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.42 179.519 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.359 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.454 179.866 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 N--CA 1.464 -0.218 0 CA-C-O 120.805 0.252 . . . . 0.0 112.366 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.4 ttt85 -72.37 141.95 48.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.833 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 77.4 p -143.34 165.13 28.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.978 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 173.8 135.52 2.03 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.421 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.8 mt -68.62 122.36 18.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 0.0 110.935 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.494 HD22 ' HB3' ' A' ' 157' ' ' LEU . 0.1 OUTLIER -131.91 158.41 41.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.723 179.797 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.81 150.95 20.82 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.071 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.418 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 7.3 tp -134.29 137.54 44.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.577 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.532 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.82 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.532 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 24.7 m95 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.733 0.302 . . . . 0.0 110.902 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.16 152.54 24.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.065 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.97 135.01 37.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.982 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.644 HG12 ' HA ' ' A' ' 43' ' ' PRO . 33.0 m -148.25 125.75 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.26 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.8 tp -69.8 135.94 50.26 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.596 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.61 HD12 HG13 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -104.53 142.0 35.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.747 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.0 m -123.12 94.53 4.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.884 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.507 HD11 HG13 ' A' ' 172' ' ' ILE . 0.4 OUTLIER -85.55 96.81 9.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.815 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -107.63 137.8 45.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.951 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -57.1 -23.0 43.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.081 0.467 . . . . 0.0 111.226 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 89.9 m-20 -85.11 -31.1 23.52 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.722 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -175.79 168.76 3.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.021 0.439 . . . . 0.0 111.315 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.535 ' C ' HD13 ' A' ' 39' ' ' LEU . 3.2 tm? -111.0 108.77 18.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.417 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.3 m -114.2 139.23 49.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.254 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.61 HG13 HD12 ' A' ' 32' ' ' LEU . 16.8 t -117.46 159.69 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.881 179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.472 ' N ' HG12 ' A' ' 41' ' ' VAL . 3.1 t -156.34 152.55 23.36 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.708 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.644 ' HA ' HG12 ' A' ' 30' ' ' VAL . 60.0 Cg_endo -72.08 47.71 1.06 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.485 2.123 . . . . 0.0 112.485 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.213 0 CA-C-O 121.118 0.485 . . . . 0.0 111.11 -179.771 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.074 0 CA-C-O 120.876 0.37 . . . . 0.0 111.082 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.473 ' HE2' HG13 ' A' ' 155' ' ' VAL . 0.9 OUTLIER -129.3 91.18 3.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.91 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -80.22 143.18 33.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.928 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.409 ' CG1' ' HB2' ' A' ' 148' ' ' ALA . 20.3 t -142.22 140.48 29.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.122 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.706 ' C ' HD22 ' A' ' 125' ' ' LEU . 1.4 m -76.74 158.52 30.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.722 HD23 ' HA ' ' A' ' 38' ' ' ALA . 3.7 mm? -123.18 43.66 2.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.939 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -142.82 35.73 1.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.846 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.779 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER 179.25 -36.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.954 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.85 -173.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.316 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.576 ' HA ' HG21 ' A' ' 176' ' ' ILE . 17.8 t80 -170.04 128.2 0.89 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.682 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.626 HG12 HD12 ' A' ' 176' ' ' ILE . 2.4 p -105.52 159.52 5.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.321 0.581 . . . . 0.0 111.493 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -165.46 134.22 3.27 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.78 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -99.59 91.88 5.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.098 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.619 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.433 ' CZ ' ' HB3' ' A' ' 156' ' ' PHE . 5.1 t80 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.84 0.352 . . . . 0.0 110.991 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.664 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.7 OUTLIER -95.6 114.63 26.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.852 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 145' ' ' GLU . . . . . 0.412 ' HG3' ' CE1' ' A' ' 156' ' ' PHE . 43.3 tt0 -120.78 128.71 53.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.994 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 1.122 HD13 HG21 ' A' ' 172' ' ' ILE . 19.6 mt -132.3 110.03 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.168 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.27 122.54 40.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.806 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.605 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -105.45 146.57 29.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.24 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.779 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.31 30.47 2.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.261 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -115.06 44.95 1.7 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.076 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.54 23.45 2.58 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.17 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 56.64 59.23 3.66 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.048 0.451 . . . . 0.0 110.978 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.605 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 6.6 m-20 -90.58 160.36 15.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.797 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -165.98 95.45 0.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.159 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.473 HG13 ' HE2' ' A' ' 121' ' ' LYS . 11.1 m -90.1 128.46 42.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.167 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.433 ' HB3' ' CZ ' ' A' ' 143' ' ' TYR . 20.9 m-85 -115.93 92.42 3.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.67 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.494 ' HB3' HD22 ' A' ' 12' ' ' LEU . 1.5 mt -98.61 168.18 10.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.128 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.467 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER -134.14 93.47 3.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.571 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 1.071 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.28 168.96 0.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.339 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -84.37 -67.27 0.81 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.959 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -90.28 164.57 14.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.943 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.99 -43.24 79.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.837 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -67.74 -32.54 73.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.077 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 62.2 m -66.28 -50.07 64.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.797 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 1.071 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -62.22 -37.51 85.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.911 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 15.0 ttt180 -72.74 -43.86 62.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.387 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.3 t -65.59 -32.9 74.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.945 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.425 ' CZ3' ' HB2' ' A' ' 34' ' ' LEU . 8.5 m95 -74.16 -53.15 10.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.691 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.664 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -58.08 -50.78 72.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.339 0.59 . . . . 0.0 110.388 179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.74 -38.38 91.84 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.554 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -71.29 -40.21 71.01 Favored 'General case' 0 CA--C 1.511 -0.545 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.999 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 1.122 HG21 HD13 ' A' ' 146' ' ' ILE . 8.4 mt -62.54 -22.7 30.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.804 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.572 ' N ' HG11 ' A' ' 130' ' ' VAL . 26.5 tt0 -77.35 -40.47 43.9 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.434 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.36 -37.53 87.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.471 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 175' ' ' GLN . . . . . 0.426 ' C ' HD12 ' A' ' 125' ' ' LEU . 4.7 mp0 -76.81 -33.08 58.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.187 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.626 HD12 HG12 ' A' ' 130' ' ' VAL . 48.1 mt -73.75 -28.92 25.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.809 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.37 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.781 179.881 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo . . . . . 0 C--O 1.232 0.195 0 CA-C-O 120.718 0.216 . . . . 0.0 112.234 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.89 152.34 18.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.761 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.665 HG22 ' HA ' ' A' ' 33' ' ' SER . 6.9 p -146.13 158.07 43.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.997 0.427 . . . . 0.0 111.219 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -156.11 135.28 4.46 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.266 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 11' ' ' LEU . 12.9 mt -62.92 106.69 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.778 0.323 . . . . 0.0 110.911 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -117.03 170.07 8.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.865 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.613 ' O ' HD23 ' A' ' 157' ' ' LEU . 9.0 mt-10 -107.68 162.68 13.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.016 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.6 tp -137.1 129.66 30.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.553 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.482 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 37.9 ttp180 . . . . . 0 C--N 1.329 -0.302 0 CA-C-O 120.874 0.369 . . . . 0.0 110.717 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.482 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 29.0 m95 . . . . . 0 N--CA 1.461 0.1 0 CA-C-O 120.924 0.392 . . . . 0.0 111.17 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -148.95 -166.72 2.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.882 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.0 ttp-105 -124.93 110.76 14.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.989 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.73 HG12 ' HA ' ' A' ' 43' ' ' PRO . 34.6 m -125.35 127.53 72.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.159 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.8 tp -76.04 115.53 15.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.409 HD13 HD22 ' A' ' 157' ' ' LEU . 0.4 OUTLIER -84.62 121.58 27.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.904 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.665 ' HA ' HG22 ' A' ' 9' ' ' THR . 17.7 m -103.61 86.84 2.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.647 HD13 HD13 ' A' ' 172' ' ' ILE . 14.7 tp -78.36 113.35 16.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.819 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -106.39 148.93 27.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.915 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -64.88 -11.71 40.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.712 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -134.84 16.6 3.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.314 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.633 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . 179.28 160.04 0.7 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.85 0.357 . . . . 0.0 111.265 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.65 ' HB2' HD21 ' A' ' 125' ' ' LEU . 66.5 tp -124.23 88.71 2.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.557 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.701 HG23 ' O ' ' A' ' 121' ' ' LYS . 79.4 m -94.29 145.31 24.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.158 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.497 HG12 ' N ' ' A' ' 42' ' ' SER . 21.2 t -125.65 160.21 32.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.019 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.497 ' N ' HG12 ' A' ' 41' ' ' VAL . 84.5 p -151.9 152.13 29.4 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.539 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.73 ' HA ' HG12 ' A' ' 30' ' ' VAL . 95.7 Cg_endo -78.93 37.68 0.68 Allowed 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.666 2.244 . . . . 0.0 112.852 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.221 0 CA-C-O 121.076 0.465 . . . . 0.0 111.325 -179.986 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.414 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.84 0.352 . . . . 0.0 111.047 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.701 ' O ' HG23 ' A' ' 40' ' ' THR . 0.8 OUTLIER -88.44 160.31 17.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.914 179.923 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.405 ' CE1' ' O ' ' A' ' 120' ' ' ALA . 16.9 m80 -152.27 113.01 4.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.77 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.449 HG11 ' HB2' ' A' ' 148' ' ' ALA . 21.5 t -119.94 133.63 66.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.144 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 13.1 t -75.46 147.11 40.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.812 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.912 HD13 ' HB3' ' A' ' 175' ' ' GLN . 18.1 mt -104.2 38.08 1.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.043 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -128.59 34.29 4.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.792 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.798 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER 179.58 -35.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.009 179.989 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.56 -173.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.347 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -170.07 111.29 0.43 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.491 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.618 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -87.45 159.18 3.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.272 0.558 . . . . 0.0 111.406 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.466 ' N ' HG22 ' A' ' 130' ' ' VAL . 97.8 p -162.05 149.14 13.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.708 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.443 ' HD3' ' HB3' ' A' ' 169' ' ' ALA . 27.9 ptt85 -118.69 95.79 4.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.965 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.847 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.805 0.336 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.776 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.9 OUTLIER -89.68 98.24 11.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.77 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -108.39 137.31 46.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.895 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.503 HD13 HG21 ' A' ' 172' ' ' ILE . 23.3 mt -137.27 108.81 6.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.144 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.3 m -92.51 135.37 34.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.864 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -113.12 144.9 41.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.187 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.798 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -94.55 30.9 1.88 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.304 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -121.44 48.17 1.72 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.129 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.28 18.77 3.68 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.375 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' GLN . . . . . 0.417 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 4.8 mm-40 58.64 61.67 2.15 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.096 0.474 . . . . 0.0 111.021 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.864 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 1.2 m-20 -89.85 163.81 14.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.8 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.85 96.47 0.44 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.068 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.3 m -97.63 121.76 48.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.169 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 156' ' ' PHE . 0.5 OUTLIER -113.05 106.29 14.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.791 179.802 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.613 HD23 ' O ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -111.92 166.23 11.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.067 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.427 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -129.15 109.96 11.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.868 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.91 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -68.83 158.76 33.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.076 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -31.5 24.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.95 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -109.32 160.54 16.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.944 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -74.16 -61.78 1.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -58.99 -27.89 65.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.172 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 45.2 t -66.64 -48.43 69.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.699 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.91 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -62.12 -42.51 99.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.973 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 40.7 mtt180 -71.27 -40.81 70.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.449 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 32.6 t -67.66 -34.38 76.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.059 0.457 . . . . 0.0 109.939 179.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.445 ' O ' HG12 ' A' ' 172' ' ' ILE . 12.9 m95 -72.5 -52.49 15.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.67 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.776 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -56.53 -45.98 80.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.171 0.51 . . . . 0.0 110.465 179.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.61 -43.98 95.85 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.518 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.36 -40.8 77.26 Favored 'General case' 0 CA--C 1.511 -0.544 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.611 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.768 HG22 HD12 ' A' ' 176' ' ' ILE . 12.9 mm -58.67 -24.81 26.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.618 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -84.12 -28.62 27.36 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.2 179.216 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.42 -40.87 77.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.247 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 175' ' ' GLN . . . . . 0.912 ' HB3' HD13 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -75.14 -41.27 58.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.004 179.156 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.768 HD12 HG22 ' A' ' 172' ' ' ILE . 54.0 mt -79.9 -10.29 12.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.268 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.448 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.367 179.8 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.793 0.247 . . . . 0.0 112.271 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.74 100.31 6.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.869 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.468 HG22 ' HA ' ' A' ' 33' ' ' SER . 20.7 p -100.65 167.8 10.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.986 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.81 132.05 2.2 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.371 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -59.91 123.46 17.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.864 0.364 . . . . 0.0 110.87 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.607 HD21 ' CD1' ' A' ' 144' ' ' LEU . 0.1 OUTLIER -136.17 170.13 16.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.801 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.571 ' O ' HD23 ' A' ' 157' ' ' LEU . 8.1 mt-10 -104.29 152.45 22.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.061 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.519 ' HB2' HG21 ' A' ' 30' ' ' VAL . 26.6 tp -138.71 137.15 36.52 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.564 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.479 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 7.1 ptt180 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.763 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.479 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 18.9 m95 . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.72 0.295 . . . . 0.0 111.026 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -96.06 165.63 12.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.887 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.7 ttp180 -84.68 147.13 27.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.008 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.519 HG21 ' HB2' ' A' ' 14' ' ' LEU . 35.5 m -155.1 144.2 12.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.983 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.9 tp -100.48 124.68 46.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.573 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.542 HD22 HD13 ' A' ' 12' ' ' LEU . 3.5 mp -89.52 151.27 22.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.915 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.468 ' HA ' HG22 ' A' ' 9' ' ' THR . 10.3 t -131.39 98.42 4.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.596 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.735 ' HA ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -86.89 95.73 9.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.025 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -99.37 142.69 30.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.931 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -59.97 -17.62 39.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.352 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -93.48 -27.87 16.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.974 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.486 ' HB1' ' O ' ' A' ' 123' ' ' VAL . . . -179.94 -170.84 0.16 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.207 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 34' ' ' LEU . 8.2 tp -115.47 154.79 28.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.823 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.615 HG23 ' CD2' ' A' ' 122' ' ' HIS . 91.3 m -155.15 140.9 18.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.07 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.422 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 3.9 t -127.61 156.18 39.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.14 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -153.52 167.43 13.59 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.495 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -79.19 45.54 1.96 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.534 2.156 . . . . 0.0 112.749 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.181 0 CA-C-O 121.01 0.433 . . . . 0.0 111.159 179.996 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.422 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.783 0.325 . . . . 0.0 111.17 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.4 ' HB2' ' HB ' ' A' ' 41' ' ' VAL . 12.3 mtmm -104.48 90.48 3.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.96 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.615 ' CD2' HG23 ' A' ' 40' ' ' THR . 12.6 m-70 -93.03 116.3 28.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.935 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.636 HG13 ' HB2' ' A' ' 148' ' ' ALA . 4.5 t -90.93 115.97 31.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.893 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 21.2 m -57.05 -28.01 62.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.259 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.3 mp 63.97 -166.94 0.22 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.809 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.1 tttt 63.14 33.44 14.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.815 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.511 ' HG3' ' HB3' ' A' ' 149' ' ' ALA . 2.3 ptt? 176.76 -35.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.79 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.407 ' HB2' ' HA ' ' A' ' 148' ' ' ALA . . . -53.6 -175.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.376 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.476 ' CE2' ' CB ' ' A' ' 147' ' ' CYS . 1.0 OUTLIER -162.07 113.96 1.69 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.75 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.611 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.3 p -89.31 159.9 2.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.381 0.61 . . . . 0.0 111.414 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.488 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.4 OUTLIER -165.98 138.28 3.97 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.866 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.02 117.23 29.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.946 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ARG . . . . . 0.444 ' CB ' ' CZ ' ' A' ' 143' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.839 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.444 ' CZ ' ' CB ' ' A' ' 133' ' ' ARG . 24.5 p90 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.817 0.341 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.937 HD23 ' HB2' ' A' ' 169' ' ' ALA . 2.7 mt -92.17 105.57 17.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' GLU . . . . . 0.441 ' HG3' ' CZ ' ' A' ' 156' ' ' PHE . 0.5 OUTLIER -100.29 115.31 29.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.938 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.978 HD13 HG21 ' A' ' 172' ' ' ILE . 28.1 mt -121.1 131.95 71.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.021 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.476 ' CB ' ' CE2' ' A' ' 129' ' ' TYR . 0.8 OUTLIER -120.47 123.41 42.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.972 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.636 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -106.22 147.34 29.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.083 0.468 . . . . 0.0 111.175 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.511 ' HB3' ' HG3' ' A' ' 127' ' ' MET . . . -95.47 30.38 2.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.303 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -112.68 43.65 1.62 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.072 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 122.39 23.84 2.29 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.106 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 56.71 59.42 3.55 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 120.943 0.401 . . . . 0.0 110.957 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.432 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 3.0 m-20 -89.03 149.59 23.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.855 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.22 89.1 1.41 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.996 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 4.7 m -87.12 122.35 38.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.315 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.441 ' CZ ' ' HG3' ' A' ' 145' ' ' GLU . 7.9 m-85 -107.16 97.99 7.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.604 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.571 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.4 mt -104.39 162.0 13.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.183 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.454 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -132.97 87.63 2.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.636 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 1.094 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -49.97 172.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.515 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.2 tttm -78.56 -67.13 0.77 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.984 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -98.07 179.27 4.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.927 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.88 -40.87 21.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.887 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.97 94.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.071 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 1.4 m -66.09 -48.04 72.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.575 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 1.094 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -64.54 -34.98 79.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.775 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.11 -45.52 56.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.305 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 53.8 p -63.63 -36.94 85.47 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.594 ' CZ3' HD12 ' A' ' 34' ' ' LEU . 10.2 m95 -69.23 -57.08 5.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.463 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.937 ' HB2' HD23 ' A' ' 144' ' ' LEU . . . -49.5 -57.81 6.35 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.321 0.581 . . . . 0.0 110.715 179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.42 -38.11 56.99 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.564 -0.743 . . . . 0.0 112.619 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.63 -40.59 76.46 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 120.675 -0.41 . . . . 0.0 111.04 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.978 HG21 HD13 ' A' ' 146' ' ' ILE . 39.0 mm -60.94 -23.88 31.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 177.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.611 ' N ' HG11 ' A' ' 130' ' ' VAL . 2.2 tt0 -78.01 -37.53 46.89 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.494 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -60.38 -46.83 88.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.614 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 89.2 mm-40 -72.02 -34.2 68.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.188 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.614 ' CD1' HG22 ' A' ' 172' ' ' ILE . 41.9 mt -70.63 -29.24 37.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.688 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.761 179.876 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.852 0.272 . . . . 0.0 112.367 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -80.28 150.93 29.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.832 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 28.0 p -152.61 162.86 40.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.915 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 172.68 133.61 1.68 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.431 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.54 HD22 ' CD ' ' A' ' 29' ' ' ARG . 17.4 mt -63.09 120.1 10.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.783 0.325 . . . . 0.0 110.991 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.967 HD13 HD22 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -127.68 170.12 13.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.995 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.706 ' O ' HD23 ' A' ' 157' ' ' LEU . 3.0 tt0 -103.36 166.55 10.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.976 0.417 . . . . 0.0 111.122 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 26.1 tp -148.45 126.71 12.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.523 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.482 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 4.4 ptt180 . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.909 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.482 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 31.0 m95 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.809 0.338 . . . . 0.0 110.967 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.86 173.62 15.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.937 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.54 ' CD ' HD22 ' A' ' 11' ' ' LEU . 0.8 OUTLIER -102.17 121.09 41.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.098 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.806 HG12 ' HA ' ' A' ' 43' ' ' PRO . 26.9 m -139.75 121.96 16.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.067 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.01 136.17 50.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.632 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.967 HD22 HD13 ' A' ' 12' ' ' LEU . 1.8 mp -102.57 159.76 15.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 t -142.11 92.06 2.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.679 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -79.39 97.38 6.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.858 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -101.01 137.49 39.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.062 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -56.82 -23.09 41.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.115 0.483 . . . . 0.0 111.229 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.523 ' OD1' ' HB1' ' A' ' 35' ' ' ALA . 6.7 p-10 -86.6 -32.28 20.71 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.778 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.63 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -178.15 175.27 1.25 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.175 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.885 ' HB2' HD13 ' A' ' 125' ' ' LEU . 0.3 OUTLIER -103.18 131.36 50.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.623 179.817 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.693 ' N ' HD13 ' A' ' 39' ' ' LEU . 70.4 m -131.1 128.41 40.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.942 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.569 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 15.9 t -114.93 159.13 14.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.136 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.469 ' N ' HG12 ' A' ' 41' ' ' VAL . 2.6 t -155.64 153.16 25.78 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.552 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.806 ' HA ' HG12 ' A' ' 30' ' ' VAL . 72.3 Cg_endo -74.33 45.13 1.15 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.548 2.165 . . . . 0.0 112.822 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.145 0 CA-C-O 120.916 0.388 . . . . 0.0 111.345 179.919 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.569 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.9 0.381 . . . . 0.0 111.136 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 17.7 mttm -117.76 103.77 10.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.92 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 8.1 m170 -101.56 101.99 12.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.042 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.433 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 2.9 t -90.03 139.43 17.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.868 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.2 p -54.83 -36.98 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.22 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.885 HD13 ' HB2' ' A' ' 39' ' ' LEU . 6.4 tp 62.71 30.71 16.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.003 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -143.85 36.66 1.29 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.41 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.406 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER 177.27 -30.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.8 -179.832 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.438 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -55.3 -166.64 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.23 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.483 ' HA ' HG21 ' A' ' 176' ' ' ILE . 14.7 t80 -165.89 122.39 1.36 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.656 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.559 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.8 p -99.28 159.97 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.399 0.619 . . . . 0.0 111.657 -179.64 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.498 ' N ' HG22 ' A' ' 130' ' ' VAL . 4.5 p -160.81 154.58 22.42 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.562 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.66 100.14 5.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.905 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.849 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.82 0.343 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.691 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.4 OUTLIER -81.21 153.21 27.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.834 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 145' ' ' GLU . . . . . 0.414 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.1 tt0 -158.77 137.78 11.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.511 HG12 HG21 ' A' ' 172' ' ' ILE . 4.5 mp -141.65 120.82 10.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.053 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.438 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 16.3 m -100.95 139.58 36.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.851 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -106.7 149.08 27.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.425 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.406 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.73 30.3 2.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.215 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -121.73 48.49 1.69 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.071 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.58 18.81 3.93 Favored Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.123 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.2 mm100 58.97 61.48 2.13 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.086 0.47 . . . . 0.0 111.005 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.5 165.54 15.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.552 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.96 96.56 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.219 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.8 m -91.85 127.09 44.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.266 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.414 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 0.2 OUTLIER -107.48 117.35 33.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.668 179.787 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.706 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.0 OUTLIER -124.72 161.3 26.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.029 -179.813 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.456 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -127.31 112.77 15.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.842 -179.903 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.959 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -71.05 172.92 8.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.094 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -80.77 -66.47 0.88 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.929 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -103.0 -178.36 3.64 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.886 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -75.84 -49.45 17.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.964 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -60.37 -36.69 78.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.151 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 66.3 m -67.62 -44.21 78.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.761 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.959 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -66.96 -37.9 85.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.809 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -73.68 -41.74 62.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.316 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 3.7 m -65.77 -32.73 74.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.924 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.497 ' CZ3' HD12 ' A' ' 34' ' ' LEU . 11.3 m95 -75.76 -54.88 6.25 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.57 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.691 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -57.44 -47.29 82.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.323 0.583 . . . . 0.0 110.407 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -60.46 -41.72 98.73 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.638 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.7 -40.19 73.0 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.855 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.693 HG22 HD12 ' A' ' 176' ' ' ILE . 17.3 mt -60.88 -24.39 32.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.559 ' N ' HG11 ' A' ' 130' ' ' VAL . 17.8 tt0 -80.61 -31.67 36.56 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.229 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -62.36 -48.83 78.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.241 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -67.89 -40.77 83.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.773 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.693 HD12 HG22 ' A' ' 172' ' ' ILE . 81.9 mt -77.6 -4.77 6.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.414 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.355 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.896 179.844 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.421 ' HB3' ' HB2' ' A' ' 35' ' ' ALA . 36.9 Cg_exo . . . . . 0 C--O 1.23 0.095 0 CA-C-O 120.914 0.298 . . . . 0.0 112.237 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.6 ttt85 -93.49 129.62 39.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.488 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.624 HG22 ' HA ' ' A' ' 33' ' ' SER . 10.6 p -137.59 140.77 41.17 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.929 0.395 . . . . 0.0 111.198 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.18 135.1 6.25 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.367 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 11' ' ' LEU . 11.3 mt -58.64 108.17 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.936 0.398 . . . . 0.0 111.006 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 157' ' ' LEU . 0.0 OUTLIER -118.87 164.79 14.91 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.755 179.859 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -102.96 155.54 18.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.946 0.403 . . . . 0.0 111.019 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 156' ' ' PHE . 5.8 tp -133.96 135.17 43.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.614 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.477 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 31.0 ttp180 . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.803 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.477 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 45.1 m95 . . . . . 0 CA--C 1.529 0.14 0 CA-C-O 120.759 0.314 . . . . 0.0 111.168 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -154.59 -172.42 4.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.945 0.403 . . . . 0.0 111.058 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -109.7 121.84 46.13 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.048 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.686 HG12 ' HA ' ' A' ' 43' ' ' PRO . 30.6 m -140.51 124.28 17.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.094 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tp -69.72 120.86 16.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.567 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.691 HD12 HG13 ' A' ' 41' ' ' VAL . 7.5 tp -89.08 116.35 27.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.017 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.624 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.2 OUTLIER -96.58 89.36 4.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.676 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.707 HD12 ' HG ' ' A' ' 39' ' ' LEU . 1.2 tp -89.15 123.99 33.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.003 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.421 ' HB2' ' HB3' ' A' ' 7' ' ' PRO . . . -134.5 149.21 50.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.027 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.4 -16.87 50.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.46 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -92.32 -27.02 17.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.013 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.424 ' HA ' HD13 ' A' ' 125' ' ' LEU . . . -178.58 176.75 0.97 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.047 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.707 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -124.33 95.6 4.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.844 179.891 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 60.5 m -102.69 130.24 49.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.984 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.691 HG13 HD12 ' A' ' 32' ' ' LEU . 9.8 t -100.72 157.64 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.06 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.429 ' N ' HG12 ' A' ' 41' ' ' VAL . 15.8 p -147.33 154.15 45.23 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.603 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.686 ' HA ' HG12 ' A' ' 30' ' ' VAL . 71.9 Cg_endo -77.43 40.51 0.85 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.592 2.195 . . . . 0.0 112.779 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.218 0 CA-C-O 121.191 0.52 . . . . 0.0 111.015 -179.973 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.81 0.338 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 12.6 mttm -106.81 81.08 1.52 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.008 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -72.24 93.63 1.49 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.873 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.49 HG13 ' HB2' ' A' ' 148' ' ' ALA . 21.5 t -88.2 111.21 22.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.207 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.29 129.06 38.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.844 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.522 HD23 ' O ' ' A' ' 175' ' ' GLN . 2.3 mp -88.9 -170.02 2.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.031 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.29 38.5 16.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.773 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.42 ' HG2' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -179.88 -38.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.858 179.956 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.73 -169.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.205 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -162.19 115.04 1.74 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.471 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.585 HG22 ' N ' ' A' ' 131' ' ' SER . 7.1 p -91.0 162.42 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.479 0.657 . . . . 0.0 111.793 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.585 ' N ' HG22 ' A' ' 130' ' ' VAL . 1.1 m -165.35 141.41 5.39 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.492 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.593 ' HD3' ' HB3' ' A' ' 169' ' ' ALA . 19.7 ptt85 -107.76 115.31 29.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.953 0.406 . . . . 0.0 111.043 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ARG . . . . . 0.466 ' O ' ' N ' ' A' ' 143' ' ' TYR . 2.8 mtp180 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.595 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.466 ' N ' ' O ' ' A' ' 133' ' ' ARG . 19.3 t80 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.816 0.341 . . . . 0.0 110.946 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.11 108.77 12.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.712 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -111.88 144.13 41.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.501 HG12 HG23 ' A' ' 130' ' ' VAL . 19.6 mt -139.1 126.03 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.066 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.8 p -111.65 117.83 33.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.542 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -98.61 146.34 25.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.236 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.42 ' HB3' ' HG2' ' A' ' 127' ' ' MET . . . -96.05 31.68 2.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.237 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -115.33 44.62 1.8 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.33 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.56 24.21 2.42 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.484 -179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 58.33 60.09 2.76 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.985 0.421 . . . . 0.0 110.969 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.542 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 0.7 OUTLIER -91.7 151.98 20.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.739 179.918 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -155.05 90.0 1.25 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.247 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 10.4 m -89.21 127.58 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.075 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.518 ' O ' HD12 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -112.78 117.23 31.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.918 179.918 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.604 ' HB3' HD23 ' A' ' 12' ' ' LEU . 1.1 mp -126.62 168.69 13.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.437 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 1.7 ttp85 -142.32 118.2 10.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.954 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.847 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -78.05 172.67 13.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.037 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.99 -31.79 12.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -106.41 140.17 39.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.926 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -66.37 -42.85 87.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.085 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.88 -46.11 75.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.067 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.47 -49.53 77.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.62 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.847 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -58.25 -38.93 77.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.139 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 166' ' ' ARG . . . . . 0.405 ' HA ' ' HD3' ' A' ' 132' ' ' ARG . 1.6 ttt-85 -69.7 -47.79 61.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.532 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.64 -30.81 71.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.022 0.439 . . . . 0.0 110.249 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.676 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 6.0 m95 -72.13 -48.95 39.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.972 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.593 ' HB3' ' HD3' ' A' ' 132' ' ' ARG . . . -57.87 -54.55 45.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.283 0.564 . . . . 0.0 110.545 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.64 -36.96 80.98 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.642 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -72.84 -39.57 66.46 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 120.966 0.413 . . . . 0.0 110.615 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.511 HG12 HD13 ' A' ' 34' ' ' LEU . 11.9 mt -61.94 -22.74 29.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.5 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.7 OUTLIER -77.96 -44.77 25.79 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.532 179.644 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.82 -33.94 77.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.591 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 175' ' ' GLN . . . . . 0.522 ' O ' HD23 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -79.45 -29.84 41.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.981 179.174 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.455 ' CD1' HG22 ' A' ' 172' ' ' ILE . 6.1 mt -68.04 -28.93 42.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.53 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.334 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.685 179.793 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo . . . . . 0 C--O 1.231 0.133 0 CA-C-O 120.846 0.269 . . . . 0.0 112.278 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.609 ' CD ' HD23 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -107.7 153.5 22.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.683 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.777 HG22 ' HA ' ' A' ' 33' ' ' SER . 28.6 p -140.35 161.37 37.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.06 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -161.31 126.49 1.59 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.414 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.683 HD13 ' HE ' ' A' ' 29' ' ' ARG . 67.9 mt -60.32 110.46 1.25 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.744 0.307 . . . . 0.0 110.936 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.435 HD13 HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -121.45 132.54 54.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.87 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.37 149.6 47.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.818 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 58.0 tp -125.51 139.69 53.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.772 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.461 ' HA ' ' CD2' ' A' ' 27' ' ' TRP . 6.1 ttm180 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.445 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.477 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 28.0 m95 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.819 0.342 . . . . 0.0 110.86 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -102.11 -173.35 2.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.972 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.683 ' HE ' HD13 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -112.15 128.03 56.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.897 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.707 HG12 ' HA ' ' A' ' 43' ' ' PRO . 25.5 m -143.62 122.95 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.172 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tp -69.82 137.01 51.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.576 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.547 HD12 HG13 ' A' ' 41' ' ' VAL . 1.8 mp -106.81 109.92 21.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.14 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.777 ' HA ' HG22 ' A' ' 9' ' ' THR . 1.2 m -85.14 88.17 7.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.604 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.968 HD12 HD13 ' A' ' 39' ' ' LEU . 3.0 tp -79.76 131.36 35.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.191 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.59 145.51 38.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.913 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.46 -15.15 48.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.447 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -96.29 -24.02 16.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.046 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.741 ' HB1' ' O ' ' A' ' 123' ' ' VAL . . . -177.42 -178.68 0.78 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 0.0 111.153 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.968 HD13 HD12 ' A' ' 34' ' ' LEU . 30.4 tp -128.32 102.88 6.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.722 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.434 HG23 ' ND1' ' A' ' 122' ' ' HIS . 58.5 m -102.91 136.39 42.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.031 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.547 HG13 HD12 ' A' ' 32' ' ' LEU . 16.7 t -109.25 159.33 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.101 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.478 ' N ' HG12 ' A' ' 41' ' ' VAL . 11.9 t -160.08 149.29 14.1 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.495 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.707 ' HA ' HG12 ' A' ' 30' ' ' VAL . 74.3 Cg_endo -75.17 46.92 1.66 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.622 2.215 . . . . 0.0 112.907 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.211 0 CA-C-O 120.972 0.415 . . . . 0.0 111.244 179.853 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.868 0.366 . . . . 0.0 111.023 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -101.33 88.88 3.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.054 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.434 ' ND1' HG23 ' A' ' 40' ' ' THR . 0.2 OUTLIER -76.69 109.01 10.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.932 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.741 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 21.5 t -109.89 150.84 12.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.102 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 87.1 p -87.48 157.24 19.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.906 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.4 ' HA ' HD12 ' A' ' 125' ' ' LEU . 1.5 tp -120.67 31.75 6.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.923 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -133.39 38.38 3.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.707 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.765 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 1.4 mtt 177.6 -34.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.874 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.459 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -55.0 -171.53 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.988 0.423 . . . . 0.0 111.31 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -168.44 116.56 0.7 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.434 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.557 HG11 ' N ' ' A' ' 173' ' ' GLN . 1.9 p -88.04 158.47 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.314 0.578 . . . . 0.0 111.579 -179.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.467 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 93.6 p -168.48 159.2 10.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.756 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 16.8 ptt85 -132.89 126.59 32.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.042 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.804 179.775 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.418 ' CD2' ' HD3' ' A' ' 158' ' ' ARG . 58.3 m-85 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.851 0.358 . . . . 0.0 110.942 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 1.045 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.3 OUTLIER -84.96 112.67 20.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.71 179.888 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 145' ' ' GLU . . . . . 0.423 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.8 tt0 -108.12 131.23 54.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.986 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.405 HG12 HG23 ' A' ' 130' ' ' VAL . 35.6 mt -132.32 110.98 17.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.189 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.459 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 30.7 p -91.66 155.36 18.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.908 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.804 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -132.89 145.83 51.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.105 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.765 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -94.54 30.51 1.98 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.289 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -119.41 47.04 1.77 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.171 0.51 . . . . 0.0 110.115 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.23 17.06 4.57 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.266 -179.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' GLN . . . . . 0.4 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 2.8 mm-40 61.11 63.95 1.18 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.049 0.452 . . . . 0.0 110.91 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.804 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 28.1 m-20 -91.07 162.69 14.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.818 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.28 96.04 0.48 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.157 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 9.4 m -90.63 124.97 43.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.199 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.423 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 0.5 OUTLIER -105.96 87.13 2.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.807 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.46 HD13 HD21 ' A' ' 32' ' ' LEU . 2.2 mt -99.86 171.25 7.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.98 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.418 ' HD3' ' CD2' ' A' ' 143' ' ' TYR . 6.5 ttp85 -143.58 116.33 8.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.884 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -70.84 172.87 8.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.205 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.74 -31.38 13.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.009 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -110.89 157.52 19.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.868 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -73.83 -57.12 4.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.851 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -61.08 -32.45 72.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.075 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 2.9 m -64.62 -52.58 56.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.8 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.884 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -59.67 -36.89 77.35 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.051 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -45.23 60.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.365 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 59.8 p -66.52 -32.4 73.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.1 179.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.592 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.1 m95 -72.56 -49.88 29.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.743 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 1.045 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -58.92 -47.33 85.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.314 0.578 . . . . 0.0 110.385 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -59.7 -40.89 97.13 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.525 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.91 -40.29 72.24 Favored 'General case' 0 CA--C 1.51 -0.592 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.894 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.863 HG22 HD12 ' A' ' 176' ' ' ILE . 10.9 mt -60.98 -24.51 33.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 177.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.557 ' N ' HG11 ' A' ' 130' ' ' VAL . 19.5 tt0 -85.3 -25.91 26.91 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.507 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.83 -42.49 73.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.196 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -76.01 -39.99 54.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.814 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.863 HD12 HG22 ' A' ' 172' ' ' ILE . 67.4 mt -80.7 -9.46 12.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.362 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.287 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.449 179.859 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo . . . . . 0 C--O 1.232 0.225 0 CA-C-O 120.916 0.298 . . . . 0.0 112.45 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -86.26 136.63 33.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.697 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.738 HG22 ' HA ' ' A' ' 33' ' ' SER . 34.0 p -136.45 148.39 47.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.954 0.407 . . . . 0.0 111.35 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.26 162.36 30.15 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.194 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.802 HD13 ' NH1' ' A' ' 29' ' ' ARG . 7.3 mt -82.98 132.93 35.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.791 0.329 . . . . 0.0 110.989 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.627 HD22 ' CB ' ' A' ' 157' ' ' LEU . 0.2 OUTLIER -146.87 145.52 29.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.738 179.815 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -79.84 158.33 26.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.104 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 12.6 tp -141.89 128.97 20.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.411 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.469 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 29.5 ttp180 . . . . . 0 C--N 1.331 -0.228 0 CA-C-O 120.894 0.378 . . . . 0.0 110.904 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.469 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 39.6 m95 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.767 0.318 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -160.74 152.66 19.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.959 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.802 ' NH1' HD13 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -77.54 120.14 22.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.921 179.903 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.401 HG21 ' HB2' ' A' ' 14' ' ' LEU . 33.3 m -130.1 133.86 63.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.062 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 12.0 tp -74.7 143.34 44.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.758 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.555 HD13 ' HB2' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -111.33 137.03 49.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.957 -179.845 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.738 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.8 OUTLIER -118.56 94.4 4.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.799 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.486 HD22 HD13 ' A' ' 172' ' ' ILE . 7.6 tp -89.31 115.3 26.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.962 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.406 ' N ' HD12 ' A' ' 34' ' ' LEU . . . -117.89 149.11 41.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.702 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.82 -15.54 31.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.31 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.401 ' O ' ' HB2' ' A' ' 38' ' ' ALA . 3.2 p30 -95.29 -26.85 15.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.236 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.681 ' HA ' HD13 ' A' ' 125' ' ' LEU . . . 179.05 171.65 0.86 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.806 0.336 . . . . 0.0 111.302 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.582 ' HB3' HG23 ' A' ' 123' ' ' VAL . 3.2 tm? -106.25 115.42 30.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.709 179.744 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.8 m -116.72 123.38 47.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.15 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.541 HG13 HD12 ' A' ' 32' ' ' LEU . 16.9 t -103.81 159.58 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.894 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.49 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.4 OUTLIER -167.34 166.47 8.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.783 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -64.52 148.26 90.54 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.577 2.185 . . . . 0.0 112.259 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.578 ' HB1' HD21 ' A' ' 11' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.054 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.481 ' HB3' ' NE2' ' A' ' 122' ' ' HIS . . . . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 120.822 0.344 . . . . 0.0 111.106 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -105.52 92.55 4.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.834 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.481 ' NE2' ' HB3' ' A' ' 120' ' ' ALA . 7.3 m-70 -93.77 109.49 21.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.198 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.593 HG12 ' CB ' ' A' ' 148' ' ' ALA . 0.6 OUTLIER -116.55 121.83 68.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.762 179.64 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 10.6 t -56.57 140.09 47.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.826 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.681 HD13 ' HA ' ' A' ' 38' ' ' ALA . 1.9 mp -97.39 31.11 2.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.981 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 mtmm -133.65 32.18 3.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.531 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.584 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -177.55 -36.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.83 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.561 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -54.94 -172.34 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.172 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -168.77 120.65 0.78 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.843 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.578 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.0 p -94.38 159.12 2.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.196 0.522 . . . . 0.0 111.123 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.468 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 13.6 t -164.46 155.11 14.85 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.846 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 21.2 ttp180 -121.52 84.04 2.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.642 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.899 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 1.5 t80 . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.926 0.393 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 1.042 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.9 OUTLIER -96.79 119.61 35.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.695 179.662 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 145' ' ' GLU . . . . . 0.428 ' HG3' ' CE1' ' A' ' 156' ' ' PHE . 9.0 tt0 -125.81 138.22 53.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.066 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.507 HD13 HG21 ' A' ' 172' ' ' ILE . 14.2 mt -134.95 112.8 15.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.073 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.561 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 18.5 m -88.48 162.07 16.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.03 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.687 ' HB3' ' HB3' ' A' ' 153' ' ' ASP . . . -144.09 146.51 32.86 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.171 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.584 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.03 30.24 2.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.337 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.22 45.47 1.76 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.131 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 117.05 23.01 4.03 Favored Glycine 0 N--CA 1.449 -0.459 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.14 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 58.78 61.93 2.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 121.096 0.474 . . . . 0.0 110.84 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.687 ' HB3' ' HB3' ' A' ' 148' ' ' ALA . 20.2 t0 -88.66 161.95 16.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.883 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -168.38 89.82 0.26 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.144 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.481 HG22 ' HB ' ' A' ' 146' ' ' ILE . 30.2 m -77.5 132.89 31.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.127 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.428 ' CE1' ' HG3' ' A' ' 145' ' ' GLU . 68.0 m-85 -111.03 92.04 3.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.647 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.627 ' CB ' HD22 ' A' ' 12' ' ' LEU . 1.8 mt -104.04 160.19 15.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.19 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.468 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 2.9 ttt180 -133.38 97.17 3.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.828 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.948 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -54.34 171.28 0.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.247 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.85 -31.05 11.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.841 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -108.36 171.53 7.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.861 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.27 -55.65 3.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.967 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.41 -28.17 68.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.206 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -52.27 37.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.7 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.948 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -61.47 -37.43 83.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.949 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -73.19 -44.04 60.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.311 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 24.8 t -66.42 -33.24 75.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.874 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.444 ' O ' HG12 ' A' ' 172' ' ' ILE . 11.5 m95 -72.5 -52.49 15.49 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.75 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 1.042 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -56.24 -45.87 79.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.291 0.567 . . . . 0.0 110.467 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.9 -44.54 96.01 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.527 -0.761 . . . . 0.0 112.734 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.09 -40.81 82.57 Favored 'General case' 0 CA--C 1.51 -0.571 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.176 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.785 HG22 HD12 ' A' ' 176' ' ' ILE . 20.8 mm -60.4 -24.91 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.578 ' N ' HG11 ' A' ' 130' ' ' VAL . 30.8 tt0 -83.63 -26.15 30.18 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.571 179.416 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.66 -49.31 63.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.21 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 175' ' ' GLN . . . . . 0.657 ' HB3' HD23 ' A' ' 125' ' ' LEU . 1.9 mp0 -69.65 -41.26 75.82 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.787 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.785 HD12 HG22 ' A' ' 172' ' ' ILE . 67.5 mt -80.05 -3.03 5.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.378 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 0.419 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.643 179.905 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo . . . . . 0 N--CA 1.466 -0.125 0 CA-C-O 120.857 0.274 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.44 146.19 36.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.786 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.881 HG22 ' HA ' ' A' ' 33' ' ' SER . 58.8 p -140.44 152.95 46.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.095 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -158.63 123.9 1.31 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.328 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 18.4 mt -64.28 100.73 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.875 0.369 . . . . 0.0 110.926 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.759 HD13 HD22 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -106.61 170.03 8.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.895 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.536 ' O ' HD23 ' A' ' 157' ' ' LEU . 0.2 OUTLIER -107.88 155.97 19.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.979 -179.971 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 13.2 tp -134.37 127.8 32.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.638 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.43 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.7 OUTLIER . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.852 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.477 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 46.6 m95 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.801 0.334 . . . . 0.0 110.962 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -147.39 152.61 38.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.018 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -80.63 121.32 25.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.041 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.666 HG12 ' HA ' ' A' ' 43' ' ' PRO . 31.9 m -134.52 137.82 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.135 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tp -86.16 127.8 34.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.616 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.759 HD22 HD13 ' A' ' 12' ' ' LEU . 0.9 OUTLIER -100.16 103.44 14.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.015 -179.768 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.881 ' HA ' HG22 ' A' ' 9' ' ' THR . 2.7 m -82.24 78.57 8.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.657 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.848 HD12 ' HG ' ' A' ' 39' ' ' LEU . 3.6 tp -74.48 93.29 2.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.17 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.46 147.8 22.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.916 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.2 -14.76 52.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.512 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.41 -17.33 14.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.237 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.423 ' C ' HD22 ' A' ' 125' ' ' LEU . . . -174.23 173.71 3.02 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.78 0.324 . . . . 0.0 111.128 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.848 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -121.37 104.63 9.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.895 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.3 m -101.45 155.03 18.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.041 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.643 HG13 HD12 ' A' ' 32' ' ' LEU . 16.2 t -138.78 159.11 30.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.147 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.485 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -165.19 158.33 13.92 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.542 179.92 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.666 ' HA ' HG12 ' A' ' 30' ' ' VAL . 6.6 Cg_exo -73.85 42.02 0.68 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.768 2.312 . . . . 0.0 112.78 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.159 0 CA-C-O 121.032 0.444 . . . . 0.0 111.302 179.923 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.82 0.343 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.519 ' HE2' HG13 ' A' ' 155' ' ' VAL . 5.5 tttp -84.47 95.28 8.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.767 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -91.16 103.11 15.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.089 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 39' ' ' LEU . 6.6 t -81.81 118.06 28.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.725 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -49.25 -34.55 15.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.516 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.614 HD13 ' HB2' ' A' ' 39' ' ' LEU . 3.8 tp 60.22 -165.21 0.21 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.665 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 54.88 38.78 30.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.991 0.424 . . . . 0.0 110.773 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.7 mtt 173.42 -30.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.762 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.06 -167.75 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.296 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.448 ' CD1' ' N ' ' A' ' 129' ' ' TYR . 0.0 OUTLIER -159.77 120.13 3.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.62 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.657 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.4 p -94.52 159.53 2.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.31 0.576 . . . . 0.0 111.272 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.481 ' N ' HG22 ' A' ' 130' ' ' VAL . 1.0 OUTLIER -169.1 125.46 0.92 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.862 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 -95.89 86.65 4.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.967 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.881 179.867 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.775 0.321 . . . . 0.0 110.849 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.465 HD11 ' HA ' ' A' ' 165' ' ' ALA . 0.2 OUTLIER -99.17 109.2 21.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.734 179.95 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -114.36 142.32 46.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.735 HD13 HG21 ' A' ' 172' ' ' ILE . 24.0 mt -146.31 107.18 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.91 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 11.7 m -92.77 133.38 36.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.052 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.68 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -108.5 150.21 27.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.406 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.24 30.69 2.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.294 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -116.3 45.78 1.71 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.075 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.22 23.49 3.2 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.145 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 57.16 59.59 3.34 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.07 0.462 . . . . 0.0 111.084 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.68 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.8 m-20 -85.74 158.61 19.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.545 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -157.98 91.66 1.13 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.206 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.519 HG13 ' HE2' ' A' ' 121' ' ' LYS . 6.6 m -92.02 117.87 36.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.219 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -110.26 83.18 1.71 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.778 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.536 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.3 mt -90.35 166.58 13.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.034 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.463 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 24.0 ttp180 -131.28 105.9 7.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.793 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.799 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -56.67 170.13 0.42 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.271 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.76 -30.49 20.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.988 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -119.11 168.87 10.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.931 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -78.02 -57.37 3.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.872 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -58.77 -35.38 72.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.173 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 164' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 168' ' ' TRP . 16.8 p -61.33 -51.89 66.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.919 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.799 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -58.67 -39.03 79.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.191 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.21 -45.42 66.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.716 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 4.9 m -67.42 -32.58 73.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.007 0.432 . . . . 0.0 110.254 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.728 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 5.1 m95 -72.98 -47.86 41.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.828 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.535 ' HA ' HD12 ' A' ' 172' ' ' ILE . . . -56.79 -58.57 7.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.315 0.579 . . . . 0.0 110.164 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.31 -40.13 60.11 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.558 -0.747 . . . . 0.0 112.588 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.35 -41.02 81.31 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.791 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.735 HG21 HD13 ' A' ' 146' ' ' ILE . 10.8 mt -59.64 -24.0 27.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 177.731 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.657 ' N ' HG11 ' A' ' 130' ' ' VAL . 11.5 tt0 -77.39 -37.57 51.73 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.013 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -59.35 -47.68 84.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.538 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -37.29 77.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.063 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.479 HD12 HG22 ' A' ' 172' ' ' ILE . 49.3 mt -68.29 -29.15 43.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.039 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 0.254 0 C-N-CA 120.398 -0.906 . . . . 0.0 112.936 179.851 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo . . . . . 0 C--O 1.23 0.118 0 CA-C-O 120.854 0.273 . . . . 0.0 112.375 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -93.83 142.24 27.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.823 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.92 HG22 ' HA ' ' A' ' 33' ' ' SER . 38.1 p -140.77 161.61 37.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.943 0.402 . . . . 0.0 111.213 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.56 140.41 5.55 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.356 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 26.8 mt -61.14 120.72 10.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.927 0.394 . . . . 0.0 110.959 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.806 HD13 HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -132.78 154.94 49.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.743 179.915 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.54 160.25 20.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.905 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 46.1 tp -141.31 126.44 18.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.632 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.437 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 2.4 ttm180 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.618 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.438 ' CH2' ' HB2' ' A' ' 158' ' ' ARG . 31.3 m95 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.659 0.266 . . . . 0.0 110.755 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.51 168.71 26.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.839 0.352 . . . . 0.0 111.068 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 -92.24 137.01 32.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.975 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 30' ' ' VAL . 29.3 m -156.44 120.77 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.021 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.2 tp -69.73 128.24 35.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.703 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.806 HD22 HD13 ' A' ' 12' ' ' LEU . 7.5 mp -92.98 139.73 30.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.99 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.92 ' HA ' HG22 ' A' ' 9' ' ' THR . 3.3 t -113.48 77.43 1.05 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.681 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.5 ' HA ' HD22 ' A' ' 39' ' ' LEU . 7.5 tp -72.99 96.25 2.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.86 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -96.29 148.09 23.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.905 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.26 -13.45 38.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.511 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -103.45 -19.03 14.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.391 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.703 ' HA ' HD13 ' A' ' 125' ' ' LEU . . . -176.2 174.42 2.02 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.968 0.413 . . . . 0.0 111.38 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.539 ' C ' HD13 ' A' ' 39' ' ' LEU . 3.0 tm? -112.94 93.94 4.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.67 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.8 m -98.99 134.74 41.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.94 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.636 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 13.1 t -106.27 158.59 6.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.98 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.449 ' N ' HG12 ' A' ' 41' ' ' VAL . 14.9 p -146.56 152.12 44.7 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.787 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.72 44.48 1.43 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.611 2.207 . . . . 0.0 112.688 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.194 0 CA-C-O 121.097 0.475 . . . . 0.0 111.188 -179.941 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.636 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.809 0.338 . . . . 0.0 111.198 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.401 ' HE2' ' CG1' ' A' ' 155' ' ' VAL . 44.8 tttp -105.38 84.74 2.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.89 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 3.2 m80 -73.84 92.21 2.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.866 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.481 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 27.4 t -85.97 120.44 35.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.171 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 1.7 m -68.53 131.85 45.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.88 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.703 HD13 ' HA ' ' A' ' 38' ' ' ALA . 1.2 mp -87.88 -168.19 2.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.857 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.07 32.69 17.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.761 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.641 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 3.2 mtt -171.04 -41.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.001 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.23 -169.69 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.138 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.467 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.3 OUTLIER -170.2 122.88 0.68 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.472 179.797 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.601 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.3 p -96.45 158.8 3.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.342 0.591 . . . . 0.0 111.539 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' HG22 ' A' ' 130' ' ' VAL . 15.8 m -151.93 166.4 31.61 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.645 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.2 ttp180 -134.04 85.8 2.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.062 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.872 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.85 0.357 . . . . 0.0 110.879 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.653 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.4 OUTLIER -111.6 115.14 28.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.581 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -117.66 136.46 53.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.055 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.619 HD13 HG21 ' A' ' 172' ' ' ILE . 28.7 mt -135.94 104.24 4.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.978 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 29.7 m -90.1 136.42 33.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.957 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -114.65 150.8 34.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.041 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.641 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -94.06 30.92 1.76 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.5 -179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -110.67 42.81 1.52 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.035 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.68 25.71 2.54 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.118 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 56.75 59.42 3.54 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.035 0.445 . . . . 0.0 110.934 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -94.08 162.75 13.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.805 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.39 93.42 0.85 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.182 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.401 ' CG1' ' HE2' ' A' ' 121' ' ' LYS . 6.6 m -83.23 128.31 38.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.13 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.437 ' CE1' ' HB3' ' A' ' 15' ' ' ARG . 0.2 OUTLIER -109.12 93.11 4.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.751 -179.91 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.583 HD22 HD11 ' A' ' 32' ' ' LEU . 1.3 mp -96.71 167.52 11.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.077 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.438 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -130.75 112.81 13.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.811 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.883 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -67.56 172.13 5.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.14 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -85.59 -66.05 0.94 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.024 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -97.96 170.86 8.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.881 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.01 -47.44 58.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.032 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.25 -38.4 90.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.139 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 30.4 t -61.75 -47.66 84.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.868 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.883 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -60.47 -41.2 93.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.224 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 51.9 mtp180 -70.08 -44.06 69.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.543 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.3 -34.32 77.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.054 179.475 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.403 ' O ' HD12 ' A' ' 172' ' ' ILE . 11.2 m95 -74.26 -50.86 17.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.834 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.653 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -56.23 -51.58 67.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.399 0.619 . . . . 0.0 110.491 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.94 -40.81 95.82 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.798 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.21 -41.09 77.55 Favored 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.355 -179.593 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.717 HG22 HD12 ' A' ' 176' ' ' ILE . 6.8 mt -62.65 -23.18 31.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.601 ' N ' HG11 ' A' ' 130' ' ' VAL . 54.2 tt0 -80.66 -30.52 36.55 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.315 179.067 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.57 -47.34 76.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.338 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 175' ' ' GLN . . . . . 0.568 ' HB3' HD21 ' A' ' 125' ' ' LEU . 2.0 mp0 -70.55 -39.37 74.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.998 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.717 HD12 HG22 ' A' ' 172' ' ' ILE . 84.5 mt -78.11 -9.95 12.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.195 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.448 179.88 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo . . . . . 0 N--CA 1.465 -0.153 0 CA-C-O 120.794 0.247 . . . . 0.0 112.306 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.63 155.76 25.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.813 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.758 HG22 ' HA ' ' A' ' 33' ' ' SER . 74.6 p -144.35 138.12 27.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.968 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -136.72 121.62 2.41 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.435 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.548 HD22 ' HD3' ' A' ' 29' ' ' ARG . 31.0 mt -68.53 114.09 6.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.876 0.37 . . . . 0.0 110.921 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.455 HD22 ' HB2' ' A' ' 157' ' ' LEU . 0.2 OUTLIER -129.21 150.24 50.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.72 179.877 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -83.58 163.22 20.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.036 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 39.6 tp -130.95 126.63 36.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.636 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.473 ' HA ' ' CD2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.63 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.473 ' CD2' ' HA ' ' A' ' 15' ' ' ARG . 22.1 m95 . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.709 0.29 . . . . 0.0 110.655 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -146.47 -175.02 4.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.994 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.548 ' HD3' HD22 ' A' ' 11' ' ' LEU . 0.3 OUTLIER -109.98 137.34 47.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 26.2 m -151.19 128.02 2.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.12 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.2 tp -81.98 127.23 32.85 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.424 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.468 HD12 HG13 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -94.16 92.78 7.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.104 -179.623 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.758 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.7 OUTLIER -73.15 89.22 1.49 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.579 179.462 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.711 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 4.6 tp -84.65 119.86 25.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.152 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -122.83 138.8 54.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.022 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -56.77 -23.2 41.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.462 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -89.55 -29.95 18.56 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.006 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.862 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -175.72 166.82 3.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.135 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.558 HD11 HG23 ' A' ' 172' ' ' ILE . 0.2 OUTLIER -103.56 152.93 21.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.752 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 88.3 m -158.21 132.64 8.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.772 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.635 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 14.7 t -117.86 159.26 18.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.214 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.483 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -155.31 176.27 2.64 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.539 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.412 ' HD2' ' CB ' ' A' ' 42' ' ' SER . 84.7 Cg_endo -82.25 38.52 0.75 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.531 2.154 . . . . 0.0 112.841 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.261 0 CA-C-O 121.116 0.484 . . . . 0.0 111.07 179.964 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.635 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.787 0.327 . . . . 0.0 111.103 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -101.4 97.72 8.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.88 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -88.94 113.94 25.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.961 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.788 HG13 ' HB2' ' A' ' 148' ' ' ALA . 21.7 t -103.18 137.92 29.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.085 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.646 ' C ' HD22 ' A' ' 125' ' ' LEU . 0.3 OUTLIER -76.27 159.79 30.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.868 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.862 HD23 ' HA ' ' A' ' 38' ' ' ALA . 4.2 mm? -123.6 34.36 5.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.974 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.29 34.84 1.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.964 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 3.3 ptp 178.55 -37.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.0 -177.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.324 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.415 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.2 OUTLIER -159.23 124.36 4.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.461 179.918 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.699 HG12 HD12 ' A' ' 176' ' ' ILE . 2.9 p -101.27 159.95 3.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.318 0.58 . . . . 0.0 111.497 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.519 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -161.45 156.13 23.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.994 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.65 139.72 53.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.772 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.793 -179.98 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.836 0.351 . . . . 0.0 111.057 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.855 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 1.2 mt -94.23 116.14 28.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.753 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -108.98 130.29 55.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.87 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.445 HG12 HG23 ' A' ' 130' ' ' VAL . 35.6 mt -132.91 120.72 42.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.097 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 35.8 t -109.78 124.27 50.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.777 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.788 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -108.53 147.51 31.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.21 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.47 30.74 2.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.179 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -112.09 42.75 1.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.404 179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.68 25.28 2.17 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.955 -0.641 . . . . 0.0 112.359 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 58.56 60.55 2.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.068 0.461 . . . . 0.0 110.923 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.523 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 1.5 m-20 -93.31 148.38 22.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.861 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -155.64 90.41 1.24 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.092 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 27.2 m -88.94 131.2 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.21 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -118.0 96.29 5.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.68 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.455 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.7 OUTLIER -103.28 167.06 10.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.041 -179.712 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.455 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 69.2 ttt180 -132.8 101.16 5.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.719 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.517 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -58.85 173.49 0.43 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.158 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.06 -33.27 10.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.935 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.03 -170.01 1.78 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.822 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -108.21 -56.66 2.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.71 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.39 -29.91 70.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.872 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 3.4 m -65.25 -47.48 76.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.504 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.572 ' HA ' HD11 ' A' ' 144' ' ' LEU . . . -61.54 -46.05 91.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.026 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -69.64 -37.91 76.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.518 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 88.5 p -70.01 -34.21 73.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.167 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.711 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 6.9 m95 -73.06 -48.88 32.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.865 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.855 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -57.3 -51.82 67.82 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.359 0.599 . . . . 0.0 110.486 179.621 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.82 -40.87 93.62 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.748 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.96 76.39 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.049 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.564 HG22 ' CD1' ' A' ' 176' ' ' ILE . 9.5 mt -61.62 -22.83 29.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.768 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.539 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -71.11 -55.53 8.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.477 179.239 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -52.73 -37.74 59.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.119 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.43 -30.46 57.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.311 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.699 HD12 HG12 ' A' ' 130' ' ' VAL . 19.4 mt -71.33 -25.91 25.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.913 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.336 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.788 179.593 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo . . . . . 0 C--O 1.231 0.14 0 CA-C-O 120.794 0.247 . . . . 0.0 112.452 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.536 ' NH2' ' HB1' ' A' ' 171' ' ' ALA . 34.3 ttp180 -97.56 143.42 28.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.977 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.0 p -141.44 154.6 45.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.938 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -159.6 135.79 4.3 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.535 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.506 HD22 ' HB1' ' A' ' 44' ' ' ALA . 66.4 mt -66.56 105.3 1.47 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.806 0.336 . . . . 0.0 110.989 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.575 HD13 HD22 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -116.26 152.34 34.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.819 179.92 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.425 ' HB3' ' CE3' ' A' ' 27' ' ' TRP . 4.5 tt0 -78.93 170.11 17.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.878 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.407 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 39.7 tp -145.33 120.81 10.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.74 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.467 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.453 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.467 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 21.7 m95 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.792 0.33 . . . . 0.0 110.776 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.56 175.88 5.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.88 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -105.62 127.03 52.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.958 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.4 m -141.46 130.26 23.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.109 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.7 tp -73.5 124.9 26.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.751 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.82 HD12 HG13 ' A' ' 41' ' ' VAL . 1.9 tp -92.39 125.38 37.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.972 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.14 87.89 3.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.78 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.728 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 4.8 tp -84.09 123.14 29.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.015 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -134.28 139.77 45.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.016 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.36 -23.53 49.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.103 0.478 . . . . 0.0 111.278 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -83.77 -31.17 26.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.89 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.685 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -174.62 169.1 3.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.262 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.521 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -112.76 106.58 14.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.723 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 28.0 m -115.7 132.04 56.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.997 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.82 HG13 HD12 ' A' ' 32' ' ' LEU . 17.6 t -106.24 160.15 5.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.921 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.479 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -165.44 167.17 9.62 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.764 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.63 148.45 65.93 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.571 2.181 . . . . 0.0 112.267 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.506 ' HB1' HD22 ' A' ' 11' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.004 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.768 0.318 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.06 78.03 1.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.861 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 21.0 m80 -71.46 146.75 48.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.057 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.4 t -149.45 113.29 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.067 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.18 147.73 52.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.064 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' A' ' 176' ' ' ILE . 3.0 mm? -98.31 -176.95 3.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.741 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 67.62 45.41 1.5 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.989 0.423 . . . . 0.0 110.95 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.578 ' HG2' ' HB3' ' A' ' 149' ' ' ALA . 0.2 OUTLIER 178.45 -37.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.768 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.696 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -68.09 -176.57 0.72 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.173 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.473 ' HA ' HG21 ' A' ' 176' ' ' ILE . 53.3 p90 -162.23 115.15 1.74 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.807 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.563 HG11 ' N ' ' A' ' 173' ' ' GLN . 1.6 p -78.78 158.92 4.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.274 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.473 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.9 OUTLIER -164.59 119.04 1.38 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.672 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 17.0 ptt-85 -94.05 86.35 4.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.866 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 10.0 mtt85 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.869 179.839 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.746 0.308 . . . . 0.0 110.758 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.658 HD12 ' HB2' ' A' ' 159' ' ' ALA . 2.3 mt -84.94 86.15 7.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.638 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.41 131.41 53.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.902 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.868 HD13 HG21 ' A' ' 172' ' ' ILE . 28.8 mt -126.87 137.38 58.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.082 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.696 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 0.8 OUTLIER -107.17 158.9 16.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.83 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.917 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -136.86 144.07 43.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.204 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.578 ' HB3' ' HG2' ' A' ' 127' ' ' MET . . . -95.73 31.16 2.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.234 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -116.44 44.88 1.9 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.457 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.74 23.22 3.12 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.432 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 59.62 62.0 1.84 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.034 0.445 . . . . 0.0 110.798 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.917 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 5.0 m-20 -94.76 156.42 16.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.814 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.82 93.64 0.82 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.152 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.2 m -83.19 130.13 36.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.162 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -106.56 89.56 3.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.837 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.3 mt -105.39 155.98 18.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.046 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.439 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 13.6 ttm180 -127.01 112.37 15.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.792 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.852 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -57.88 173.51 0.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.124 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.91 -31.11 11.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.99 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.92 -179.59 3.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -87.63 -59.16 2.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.875 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -62.24 -33.25 74.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.128 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.89 -44.86 84.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.753 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.852 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -64.37 -43.56 94.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.022 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.78 -41.07 75.61 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.158 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 60.5 p -65.32 -40.67 94.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.728 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 8.7 m95 -66.52 -55.59 14.83 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.505 179.296 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.47 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -46.02 -64.99 0.61 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.19 0.519 . . . . 0.0 110.897 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -49.7 -36.77 26.13 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.105 179.366 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 171' ' ' ALA . . . . . 0.536 ' HB1' ' NH2' ' A' ' 8' ' ' ARG . . . -69.0 -40.35 78.77 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.968 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.868 HG21 HD13 ' A' ' 146' ' ' ILE . 30.6 mm -59.68 -24.28 28.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 177.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.563 ' N ' HG11 ' A' ' 130' ' ' VAL . 2.7 tt0 -75.71 -44.64 40.98 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.779 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.76 -48.69 77.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.169 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -71.21 -32.06 68.36 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.067 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.721 ' HA ' HD12 ' A' ' 125' ' ' LEU . 7.0 mt -66.04 -28.85 44.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.619 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.361 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.632 179.786 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo . . . . . 0 C--O 1.231 0.155 0 CA-C-O 120.879 0.283 . . . . 0.0 112.395 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.96 121.31 42.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.423 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.42 HG22 ' HA ' ' A' ' 33' ' ' SER . 9.0 p -132.25 139.56 48.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.014 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.82 143.35 12.15 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.485 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' A' ' 11' ' ' LEU . 6.7 mt -69.52 106.98 3.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.764 0.316 . . . . 0.0 110.891 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.044 HD21 HD12 ' A' ' 144' ' ' LEU . 0.2 OUTLIER -121.95 144.22 49.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.649 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.431 ' O ' HD23 ' A' ' 157' ' ' LEU . 18.4 mt-10 -84.02 155.82 22.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.948 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tp -136.09 137.78 41.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.664 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.492 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.679 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.492 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 26.9 m95 . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.886 0.375 . . . . 0.0 111.139 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -108.6 146.86 32.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.806 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.7 ttt85 -72.9 136.07 45.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.008 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 42' ' ' SER . 35.1 m -141.17 169.95 14.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.109 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 tp -120.63 117.25 27.05 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.641 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.632 ' HG ' HG22 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -87.93 110.49 20.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.947 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.42 ' HA ' HG22 ' A' ' 9' ' ' THR . 7.8 t -89.85 79.86 6.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.666 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.99 HD12 HD23 ' A' ' 39' ' ' LEU . 1.1 tp -77.11 99.83 5.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.046 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.68 147.54 27.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.935 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -61.9 -16.22 48.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.444 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.49 -27.28 18.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.861 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.869 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -176.78 -179.74 1.0 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.974 0.416 . . . . 0.0 111.255 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.99 HD23 HD12 ' A' ' 34' ' ' LEU . 3.1 tm? -117.29 114.29 23.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.859 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 58.4 m -127.72 134.77 49.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.986 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.632 HG22 ' HG ' ' A' ' 32' ' ' LEU . 14.6 t -111.7 159.01 11.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.3 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.482 ' N ' HG12 ' A' ' 41' ' ' VAL . 9.9 p -148.04 160.64 37.05 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.372 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.405 ' HA ' HG12 ' A' ' 30' ' ' VAL . 72.2 Cg_endo -77.11 47.43 2.23 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.496 2.131 . . . . 0.0 112.871 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.149 0 CA-C-O 121.018 0.437 . . . . 0.0 111.549 179.843 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.088 0 CA-C-O 120.717 0.294 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 17.1 mttm -101.8 90.66 4.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.928 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 29.0 m-70 -84.98 138.91 32.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 19.2 t -138.45 116.88 13.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.074 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 92.5 p -70.8 125.15 26.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.905 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.869 HD23 ' HA ' ' A' ' 38' ' ' ALA . 4.1 mm? -66.52 -179.48 0.84 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.917 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 60.48 35.77 20.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.859 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.41 ' SD ' ' HB3' ' A' ' 149' ' ' ALA . 2.5 mmt -164.74 -44.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.89 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.64 -165.54 0.06 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.256 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.648 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.1 OUTLIER -169.86 127.07 0.87 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.503 179.92 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.585 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.5 p -99.84 158.88 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.361 0.6 . . . . 0.0 111.646 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.481 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -166.5 133.0 2.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.677 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.444 ' HD3' ' HB3' ' A' ' 169' ' ' ALA . 39.4 ptt85 -102.96 96.05 6.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.846 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.914 -179.952 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.452 ' CZ ' ' CD ' ' A' ' 158' ' ' ARG . 15.0 m-85 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.817 0.342 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 1.044 HD12 HD21 ' A' ' 12' ' ' LEU . 80.8 mt -83.58 132.63 34.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.777 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -133.68 125.36 28.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.789 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.493 HD11 HD13 ' A' ' 172' ' ' ILE . 22.8 mt -130.46 117.99 41.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.187 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 35.5 m -100.3 143.55 30.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.829 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.817 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -112.77 149.01 33.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.308 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.41 ' HB3' ' SD ' ' A' ' 127' ' ' MET . . . -95.92 30.58 2.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.255 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -120.98 48.15 1.69 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.074 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.35 19.11 3.58 Favored Glycine 0 N--CA 1.451 -0.332 0 CA-C-N 115.615 -0.72 . . . . 0.0 112.173 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 5.2 mm100 58.45 61.14 2.34 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 121.123 0.487 . . . . 0.0 111.063 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.817 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.9 m-20 -87.6 161.97 17.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.835 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.61 93.7 0.84 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.1 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.0 m -85.71 124.57 40.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.029 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -105.98 106.06 16.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.765 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.431 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.8 mt -113.76 164.6 13.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.076 -179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.452 ' CD ' ' CZ ' ' A' ' 143' ' ' TYR . 1.3 tpt180 -130.96 97.29 4.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.694 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.817 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.52 174.15 0.11 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.413 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -88.85 -67.21 0.85 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.003 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.39 173.84 7.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.105 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.52 -34.01 25.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.923 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -74.2 -46.33 42.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.936 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.5 -39.97 95.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.651 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.817 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -66.69 -42.34 86.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.997 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.7 mtt180 -70.7 -40.68 72.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.55 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 41.9 p -67.98 -33.05 73.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.145 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.596 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.7 m95 -73.0 -50.86 20.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.875 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.737 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -56.45 -50.06 72.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.306 0.574 . . . . 0.0 110.467 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.26 -42.2 95.32 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.647 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.04 -40.53 78.54 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.964 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.756 HG22 HD12 ' A' ' 176' ' ' ILE . 31.8 mt -60.89 -24.51 32.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.585 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.1 OUTLIER -81.77 -28.78 33.09 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.219 179.161 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.76 -50.54 66.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.128 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -67.29 -41.54 85.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.856 178.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.756 HD12 HG22 ' A' ' 172' ' ' ILE . 83.1 mt -77.39 -5.59 7.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.224 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.331 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.541 179.847 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo . . . . . 0 C--O 1.231 0.158 0 CA-C-O 120.775 0.24 . . . . 0.0 112.36 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.764 ' HB3' HD23 ' A' ' 34' ' ' LEU . 5.4 ttm105 -70.59 133.98 47.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.874 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.462 HG22 ' HA ' ' A' ' 33' ' ' SER . 75.2 p -135.17 138.86 44.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.005 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.51 126.88 2.9 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.38 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.623 HD13 HH11 ' A' ' 29' ' ' ARG . 64.4 mt -68.85 99.38 1.03 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.823 0.344 . . . . 0.0 110.937 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.607 HD22 ' CB ' ' A' ' 157' ' ' LEU . 0.2 OUTLIER -106.03 151.17 24.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.788 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -88.35 134.79 33.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.513 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 20.6 tp -108.39 139.17 43.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.495 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.539 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.226 0 CA-C-O 120.746 0.307 . . . . 0.0 110.918 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.539 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 33.5 m95 . . . . . 0 CA--C 1.528 0.106 0 CA-C-O 120.796 0.331 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -89.65 -176.69 5.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.686 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.623 HH11 HD13 ' A' ' 11' ' ' LEU . 0.7 OUTLIER -106.41 130.08 54.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.851 0.358 . . . . 0.0 110.911 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 33.8 m -137.11 134.14 47.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.264 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 10.5 tp -78.86 128.12 32.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.7 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.658 HD12 HG13 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -99.38 123.6 43.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.045 -179.907 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.462 ' HA ' HG22 ' A' ' 9' ' ' THR . 1.1 t -97.51 89.87 4.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.708 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.774 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 2.5 tp -93.56 95.11 9.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.04 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.46 153.11 22.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.915 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -64.44 -14.04 54.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.409 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -96.13 -21.94 17.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.094 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.777 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -178.15 174.2 1.38 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.844 0.354 . . . . 0.0 111.134 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.601 HD13 HD12 ' A' ' 34' ' ' LEU . 21.6 tp -131.21 97.5 4.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.773 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 51.8 m -111.53 137.44 49.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.946 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.658 HG13 HD12 ' A' ' 32' ' ' LEU . 15.6 t -100.25 159.55 3.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.047 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.482 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -170.05 149.71 3.43 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.814 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.89 153.06 16.0 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.511 2.141 . . . . 0.0 112.13 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.122 -179.985 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.649 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.853 0.358 . . . . 0.0 111.06 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.455 ' HD2' HG12 ' A' ' 155' ' ' VAL . 31.8 mttt -131.74 91.51 3.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.951 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -70.1 134.49 48.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.763 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.582 HG13 ' HB2' ' A' ' 148' ' ' ALA . 22.0 t -133.65 116.86 25.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.079 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.64 ' C ' HD22 ' A' ' 125' ' ' LEU . 5.1 m -62.46 164.5 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.984 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.777 HD23 ' HA ' ' A' ' 38' ' ' ALA . 4.4 mm? -124.48 33.55 5.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.911 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -145.33 35.93 1.09 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.891 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.5 tpt -178.67 -37.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.994 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.12 -169.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.306 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.537 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.4 OUTLIER -167.87 122.85 1.0 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.537 179.894 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.69 HG12 HD12 ' A' ' 176' ' ' ILE . 2.2 p -98.61 159.31 3.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.288 0.565 . . . . 0.0 111.525 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.473 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 12.5 m -162.94 157.7 21.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.743 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.412 ' HB3' ' NH1' ' A' ' 132' ' ' ARG . 12.7 ttp-105 -140.09 117.95 11.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.956 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.831 179.843 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 2.0 t80 . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.858 0.361 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.786 HD21 ' HB2' ' A' ' 169' ' ' ALA . 7.1 mt -120.39 126.51 50.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.793 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -134.53 132.16 38.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.885 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.547 HD13 HG21 ' A' ' 172' ' ' ILE . 18.5 mt -129.49 125.8 62.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.128 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 30.4 p -104.74 130.96 52.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.738 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -110.18 147.31 33.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.167 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.97 30.57 2.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.306 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -115.74 45.29 1.73 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.191 0.519 . . . . 0.0 110.139 179.433 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 118.68 22.16 3.73 Favored Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.191 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 58.74 61.65 2.13 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 121.14 0.495 . . . . 0.0 110.826 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.738 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 4.6 m-20 -88.12 158.96 18.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.802 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -157.21 85.44 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.191 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.455 HG12 ' HD2' ' A' ' 121' ' ' LYS . 4.7 m -80.0 123.82 37.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.192 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -105.91 106.54 17.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.644 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.607 ' CB ' HD22 ' A' ' 12' ' ' LEU . 2.1 mt -119.85 160.85 21.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.151 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.423 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 22.5 ttt180 -132.46 107.74 8.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.764 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.983 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -58.68 173.05 0.44 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.228 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.02 -29.4 14.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.888 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -123.66 143.99 49.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.906 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -45.96 82.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.962 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.71 -39.94 88.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.007 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 68.4 m -61.91 -48.92 78.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.686 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.983 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -59.52 -39.75 84.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.031 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 5.0 mtt85 -69.9 -46.71 64.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.41 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.5 t -64.51 -33.23 75.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.219 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.774 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -72.93 -51.25 19.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.845 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.786 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -55.72 -56.26 22.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.309 0.576 . . . . 0.0 110.516 179.692 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.41 -36.85 78.79 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.752 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -71.84 -39.86 69.46 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.157 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.547 HG21 HD13 ' A' ' 146' ' ' ILE . 7.4 mt -63.58 -22.2 30.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.606 -0.886 . . . . 0.0 108.606 177.764 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.577 ' N ' HG11 ' A' ' 130' ' ' VAL . 1.2 tp60 -77.76 -40.88 39.45 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.483 179.546 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.49 -33.05 75.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.766 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 175' ' ' GLN . . . . . 0.408 ' HB3' HD12 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -82.58 -29.39 30.29 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.09 179.268 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.69 HD12 HG12 ' A' ' 130' ' ' VAL . 17.2 mt -71.59 -27.75 29.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.691 179.396 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 0.288 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.612 179.739 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo . . . . . 0 C--O 1.231 0.146 0 CA-C-O 120.779 0.241 . . . . 0.0 112.356 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.491 ' HD2' HD23 ' A' ' 34' ' ' LEU . 4.3 ptp180 -112.93 135.69 53.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.868 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.4 p -124.61 168.44 13.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.966 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.55 126.71 1.25 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.47 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.502 HD22 ' HD3' ' A' ' 29' ' ' ARG . 10.5 mt -59.68 128.05 35.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.843 0.354 . . . . 0.0 110.932 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.853 HD21 HD12 ' A' ' 144' ' ' LEU . 0.2 OUTLIER -145.48 140.68 27.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.806 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.95 154.93 37.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.939 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 16.1 tp -134.73 130.96 37.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.452 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.506 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 2.6 ttp180 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.801 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.506 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 43.0 m95 . . . . . 0 CA--C 1.529 0.147 0 CA-C-O 120.738 0.304 . . . . 0.0 111.02 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -153.17 158.08 41.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.095 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.502 ' HD3' HD22 ' A' ' 11' ' ' LEU . 1.5 ttm180 -82.34 123.56 29.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.946 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.682 HG12 ' HA ' ' A' ' 43' ' ' PRO . 20.5 m -143.31 123.22 9.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.209 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 11' ' ' LEU . 1.0 OUTLIER -69.85 134.85 48.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.613 179.762 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.84 121.85 41.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.979 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.2 t -100.37 86.0 3.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.694 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.501 HD12 ' CG ' ' A' ' 39' ' ' LEU . 1.7 tp -80.27 129.65 34.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.028 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.655 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -135.26 138.67 43.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.06 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.72 -23.69 44.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.037 0.446 . . . . 0.0 111.285 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -88.83 -30.15 19.16 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.929 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.655 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -175.41 173.01 2.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.032 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.501 ' CG ' HD12 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -114.71 129.01 56.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.942 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.496 ' CG2' ' HB1' ' A' ' 120' ' ' ALA . 28.6 m -128.33 129.65 46.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.752 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.461 HG12 ' N ' ' A' ' 42' ' ' SER . 13.9 t -107.28 159.02 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.317 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.461 ' N ' HG12 ' A' ' 41' ' ' VAL . 11.3 t -159.59 149.0 14.46 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.451 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.682 ' HA ' HG12 ' A' ' 30' ' ' VAL . 66.7 Cg_endo -75.07 43.03 0.92 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.654 2.236 . . . . 0.0 113.23 -179.663 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.237 0 CA-C-O 120.939 0.399 . . . . 0.0 111.846 179.594 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.496 ' HB1' ' CG2' ' A' ' 40' ' ' THR . . . . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.748 0.308 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 94.11 6.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.803 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -86.33 104.54 15.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.996 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.2 t -108.19 139.89 28.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.039 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.9 152.21 19.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.961 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.423 HD13 ' HB2' ' A' ' 39' ' ' LEU . 4.8 tp -131.95 31.47 4.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.903 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.95 41.74 2.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.724 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 174.88 -32.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.914 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.32 -171.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.378 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -161.23 107.1 1.38 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.587 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.599 HG11 ' N ' ' A' ' 173' ' ' GLN . 1.6 p -80.23 158.64 4.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.233 0.539 . . . . 0.0 111.359 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.472 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.4 OUTLIER -160.48 150.04 17.53 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.646 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.5 ptt85 -124.0 111.48 16.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.086 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.816 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 1.9 t80 . . . . . 0 CA--C 1.527 0.059 0 CA-C-O 120.74 0.305 . . . . 0.0 110.829 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.853 HD12 HD21 ' A' ' 12' ' ' LEU . 91.4 mt -96.2 139.88 31.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.918 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -148.1 130.02 15.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.729 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 14.8 mt -130.89 123.26 53.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.295 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 60.1 m -108.42 119.38 39.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.667 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -100.11 143.14 30.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.377 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.58 30.89 2.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.167 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -121.35 47.8 1.78 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.381 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 125.69 18.7 2.39 Favored Glycine 0 CA--C 1.519 0.292 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.524 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 58.95 60.93 2.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.973 0.416 . . . . 0.0 110.925 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -93.44 152.94 18.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.713 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -160.49 86.88 0.74 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.085 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 155' ' ' VAL . 35.5 m -84.12 124.83 40.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.111 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -109.47 102.47 11.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.904 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.0 mt -113.67 167.99 10.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.136 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.452 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 5.5 ttt-85 -144.4 97.6 3.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.702 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 1.049 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.69 171.28 0.22 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.423 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.42 -30.54 13.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.029 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -105.97 164.83 11.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.893 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -79.98 -65.31 1.02 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.958 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -60.04 -26.79 66.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.151 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 4.5 t -68.96 -43.49 74.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.908 0.385 . . . . 0.0 110.282 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 1.049 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -73.31 -28.23 61.97 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.544 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 11.1 ptt85 -79.28 -40.48 30.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.429 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.3 t -70.95 -31.76 68.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.108 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.487 ' O ' HD12 ' A' ' 172' ' ' ILE . 9.9 m95 -71.51 -47.4 55.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.854 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.424 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -58.17 -48.95 78.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.263 0.554 . . . . 0.0 110.465 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.45 -42.48 95.85 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.581 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.89 -40.76 75.47 Favored 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 120.854 -0.338 . . . . 0.0 110.746 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.56 ' C ' HG11 ' A' ' 130' ' ' VAL . 11.8 mt -61.11 -23.12 28.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.599 ' N ' HG11 ' A' ' 130' ' ' VAL . 1.2 tt0 -77.74 -42.1 35.41 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.618 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.82 -43.68 92.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.487 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 74.6 mm-40 -67.28 -37.23 83.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.074 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.404 HD13 HG22 ' A' ' 172' ' ' ILE . 0.1 OUTLIER -59.8 -33.27 51.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.694 179.494 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.593 179.973 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.79 0.246 . . . . 0.0 112.309 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -110.61 144.85 38.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.739 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.667 HG22 ' HA ' ' A' ' 33' ' ' SER . 18.2 p -133.32 164.03 28.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -158.08 118.64 0.84 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.338 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.853 HD22 ' HD3' ' A' ' 29' ' ' ARG . 17.8 mt -59.44 93.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.843 0.354 . . . . 0.0 110.913 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.812 HD13 HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -96.32 170.04 9.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.787 -179.994 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -110.94 146.93 35.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.964 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 14.6 tp -125.37 142.99 51.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.738 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.478 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.697 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.478 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 12.1 m95 . . . . . 0 C--O 1.233 0.197 0 CA-C-O 120.77 0.319 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -65.95 178.97 0.97 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.136 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.853 ' HD3' HD22 ' A' ' 11' ' ' LEU . 3.8 tmm_? -117.92 110.82 18.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.824 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.839 HG12 ' HA ' ' A' ' 43' ' ' PRO . 29.0 m -113.96 138.44 43.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.157 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.0 tp -83.69 127.42 33.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.561 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.828 HD12 HG13 ' A' ' 41' ' ' VAL . 2.6 mp -98.16 101.28 12.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.119 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.667 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.7 OUTLIER -86.45 94.03 9.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.648 179.735 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.523 HD12 HD11 ' A' ' 39' ' ' LEU . 2.1 tp -87.69 129.81 35.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.992 -179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -135.72 140.07 44.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.972 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.7 -23.09 49.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.072 0.463 . . . . 0.0 111.251 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -86.47 -30.85 21.71 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.93 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.546 ' HA ' HD22 ' A' ' 125' ' ' LEU . . . -178.16 -178.66 0.67 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.99 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.523 HD11 HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -113.37 157.6 21.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.922 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.486 HG23 ' CE1' ' A' ' 122' ' ' HIS . 24.7 m -158.24 128.02 5.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.626 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.828 HG13 HD12 ' A' ' 32' ' ' LEU . 10.7 t -119.78 157.97 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.012 0.434 . . . . 0.0 111.348 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.452 ' N ' HG12 ' A' ' 41' ' ' VAL . 12.5 t -160.1 157.57 25.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.406 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.839 ' HA ' HG12 ' A' ' 30' ' ' VAL . 7.0 Cg_exo -73.85 39.56 0.52 Allowed 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.732 2.288 . . . . 0.0 112.973 -179.57 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.177 0 CA-C-O 121.018 0.437 . . . . 0.0 111.404 -179.999 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.694 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.786 0.327 . . . . 0.0 111.071 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.572 ' HD2' HG11 ' A' ' 155' ' ' VAL . 18.1 mttm -121.07 108.86 14.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.897 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.486 ' CE1' HG23 ' A' ' 40' ' ' THR . 17.9 m-70 -109.92 144.63 38.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.949 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.643 HG13 ' HB2' ' A' ' 148' ' ' ALA . 4.0 t -123.39 127.32 74.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.869 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 56.4 p -58.27 -30.19 66.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.231 -179.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.546 HD22 ' HA ' ' A' ' 38' ' ' ALA . 2.1 mp 65.05 31.01 11.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.928 0.394 . . . . 0.0 110.832 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.18 36.12 3.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.716 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.588 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 1.5 mtp 170.01 -28.85 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.896 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -51.32 -177.86 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.976 0.417 . . . . 0.0 111.574 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -165.08 115.97 1.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.514 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.574 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -89.66 158.61 2.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.287 0.565 . . . . 0.0 111.487 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -167.92 128.08 1.34 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.707 -179.947 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.27 112.21 24.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.083 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.762 179.925 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 . . . . . 0 CA--C 1.527 0.077 0 CA-C-O 120.785 0.326 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.567 HD21 ' N ' ' A' ' 169' ' ' ALA . 1.1 mt -83.32 88.93 6.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.878 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -96.51 137.81 35.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.965 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.793 HD13 HG21 ' A' ' 172' ' ' ILE . 25.2 mt -141.46 126.76 18.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.035 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 63.8 m -114.22 130.6 56.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.049 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.643 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -112.15 152.03 28.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.103 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.588 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.87 30.96 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.356 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -111.03 42.41 1.64 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.336 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.22 26.79 1.96 Allowed Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.354 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 57.59 59.24 3.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.106 0.479 . . . . 0.0 111.006 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 153' ' ' ASP . . . . . 0.443 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 0.7 OUTLIER -90.13 152.3 21.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.774 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.13 94.23 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.056 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.572 HG11 ' HD2' ' A' ' 121' ' ' LYS . 10.8 m -95.76 132.98 38.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.169 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.449 ' CD1' ' N ' ' A' ' 156' ' ' PHE . 0.7 OUTLIER -119.06 98.77 6.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.897 179.918 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.58 HD13 HD21 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -106.02 167.92 9.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.937 -179.922 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 158' ' ' ARG . . . . . 0.446 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.9 OUTLIER -129.46 107.34 9.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.776 179.976 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.789 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -59.39 173.45 0.51 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.15 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.23 -30.14 16.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.039 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -122.53 157.78 31.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.929 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.09 -42.62 69.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.062 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.7 76.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.98 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 60.4 p -63.9 -44.26 93.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.653 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.789 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -62.84 -43.86 97.68 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.923 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.67 -42.4 77.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.484 179.706 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 91.1 p -66.57 -34.67 78.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.2 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 168' ' ' TRP . . . . . 0.491 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 12.1 m95 -73.0 -50.13 24.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.785 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 169' ' ' ALA . . . . . 0.567 ' N ' HD21 ' A' ' 144' ' ' LEU . . . -56.31 -51.13 69.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.271 0.557 . . . . 0.0 110.592 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.73 -41.31 95.79 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.71 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.41 -41.33 80.6 Favored 'General case' 0 CA--C 1.511 -0.544 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.141 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.873 HG22 HD12 ' A' ' 176' ' ' ILE . 7.0 mt -62.41 -23.38 32.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 173' ' ' GLN . . . . . 0.574 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.0 OUTLIER -79.97 -30.73 39.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.353 179.286 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -66.36 -47.03 74.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.423 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -71.05 -37.02 72.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.234 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 176' ' ' ILE . . . . . 0.873 HD12 HG22 ' A' ' 172' ' ' ILE . 70.3 mt -83.33 -5.95 9.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.373 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.321 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.321 179.828 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.798 0.332 . . . . 0.0 110.988 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.5 m -153.58 78.53 1.14 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.857 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.29 148.07 3.61 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.476 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.48 -40.95 3.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.867 0.365 . . . . 0.0 110.924 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.0 tpp85 -65.46 90.72 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.828 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.16 136.3 23.7 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.101 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.17 158.73 51.45 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.496 2.13 . . . . 0.0 112.281 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.5 ttm-85 -82.56 130.25 35.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.559 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.805 HG22 ' HA ' ' A' ' 33' ' ' SER . 21.7 p -120.65 146.37 46.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.971 0.415 . . . . 0.0 111.224 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -134.73 127.69 4.54 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.465 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' A' ' 11' ' ' LEU . 8.1 mt -69.82 101.24 1.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.944 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.812 HD13 HD22 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -121.23 164.2 17.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.717 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.688 ' O ' HD23 ' A' ' 157' ' ' LEU . 0.9 OUTLIER -89.55 163.79 15.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.959 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.452 ' HB2' HG21 ' A' ' 30' ' ' VAL . 18.1 tp -137.53 124.67 21.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.665 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.48 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 33.8 ttt180 -69.52 169.16 13.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.657 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 13.9 t -169.63 41.66 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.827 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -125.35 30.42 4.52 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.515 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.33 121.43 12.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.765 0.317 . . . . 0.0 111.123 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -167.41 -67.53 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.53 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.3 t -169.93 -68.46 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.758 0.313 . . . . 0.0 110.835 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.03 -145.54 2.04 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.532 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -151.25 30.58 0.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.807 0.337 . . . . 0.0 111.127 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -112.75 27.63 9.61 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.453 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -158.36 49.24 0.42 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.51 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -78.69 136.97 37.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.796 0.331 . . . . 0.0 110.959 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.8 50.39 1.35 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.814 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.48 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.4 m95 -48.98 168.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.167 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -166.63 141.61 4.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -64.2 136.04 56.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.007 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.452 HG21 ' HB2' ' A' ' 14' ' ' LEU . 31.6 m -146.36 169.98 5.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.12 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.478 HD23 ' HA ' ' A' ' 31' ' ' LEU . 0.7 OUTLIER -107.17 141.62 38.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.725 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 1.117 HD21 HD13 ' A' ' 157' ' ' LEU . 9.9 mp -114.54 82.84 1.79 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.901 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.805 ' HA ' HG22 ' A' ' 9' ' ' THR . 1.0 OUTLIER -69.95 88.9 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.58 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.109 HD12 HD23 ' A' ' 39' ' ' LEU . 1.7 tp -87.73 119.18 27.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.236 -179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -109.79 156.07 20.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.815 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -49.9 -22.82 1.64 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.793 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.444 ' HA ' HD12 ' A' ' 125' ' ' LEU . 3.6 p30 -152.87 38.14 0.51 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.204 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.564 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -175.2 119.92 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.957 0.408 . . . . 0.0 111.646 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.109 HD23 HD12 ' A' ' 34' ' ' LEU . 3.0 tm? -104.16 100.88 10.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.496 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.412 ' HG1' ' CE1' ' A' ' 122' ' ' HIS . 85.5 m -109.78 126.75 54.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.369 -179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.603 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 11.5 t -94.56 158.57 2.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.391 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.417 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -149.52 166.4 15.33 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.904 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -82.6 50.72 3.49 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.658 2.238 . . . . 0.0 112.46 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 49.23 30.33 3.05 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.188 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -141.79 179.6 6.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.021 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -109.89 176.34 19.2 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.473 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -94.73 131.04 31.45 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.506 0.193 . . . . 0.0 110.942 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.7 124.25 8.64 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.457 2.104 . . . . 0.0 112.349 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.21 -149.21 6.4 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.483 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.05 -8.03 22.7 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.639 2.226 . . . . 0.0 112.62 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -100.58 95.79 4.71 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-O 120.669 0.271 . . . . 0.0 110.871 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -68.76 164.31 33.84 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.493 2.129 . . . . 0.0 112.276 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.42 137.98 18.35 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.89 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -74.28 163.17 37.03 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.454 2.103 . . . . 0.0 112.298 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.486 ' HB1' ' O ' ' A' ' 109' ' ' SER . . . -60.65 176.18 0.4 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.049 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -116.4 128.14 55.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.876 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.8 mt -87.51 138.22 31.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.907 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -108.81 -63.11 1.38 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.902 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 117.17 -86.31 0.41 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.415 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -139.73 120.88 14.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.33 . . . . 0.0 111.044 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -154.21 102.62 2.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.15 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -94.46 152.05 39.77 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.851 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.19 135.46 52.78 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.487 2.125 . . . . 0.0 112.33 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 160.64 65.51 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.451 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.829 ' HB1' ' HG2' ' A' ' 68' ' ' PRO . . . -137.85 98.02 3.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.846 0.355 . . . . 0.0 111.153 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.734 ' HB3' ' HD3' ' A' ' 67' ' ' PRO . . . -87.02 -51.15 0.44 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.709 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.734 ' HD3' ' HB3' ' A' ' 66' ' ' ALA . 52.9 Cg_exo -52.13 -46.99 29.02 Favored 'Trans proline' 0 CA--C 1.529 0.238 0 C-N-CA 122.895 2.397 . . . . 0.0 112.958 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.829 ' HG2' ' HB1' ' A' ' 65' ' ' ALA . 90.3 Cg_endo -82.17 134.84 8.22 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.82 2.346 . . . . 0.0 112.308 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -138.79 117.68 12.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.967 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.1 mt -125.92 103.91 26.98 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.854 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.53 -166.32 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.452 2.102 . . . . 0.0 112.308 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.532 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.6 mt-10 67.21 72.58 0.35 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.334 0.587 . . . . 0.0 110.618 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.532 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 168.89 -43.34 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.562 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.537 ' H ' HD12 ' A' ' 74' ' ' LEU . 1.1 mp -89.52 -33.28 16.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.744 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.7 mp -65.87 -33.15 75.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.819 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.6 -46.02 15.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.772 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -95.16 55.25 1.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.949 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 3.7 ttp180 -92.25 -39.53 11.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.945 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -96.99 39.95 1.16 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.905 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.2 t -133.94 -44.76 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.155 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.472 ' N ' ' HD2' ' A' ' 82' ' ' PRO . 0.5 OUTLIER -56.54 -55.75 39.5 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.274 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.472 ' HD2' ' N ' ' A' ' 81' ' ' SER . 67.3 Cg_endo -76.07 58.88 5.71 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.893 2.395 . . . . 0.0 112.459 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 55.07 -168.92 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.153 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -164.34 166.59 20.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 71.12 -63.72 0.41 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.944 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -95.91 35.18 1.43 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.959 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -109.98 -31.26 7.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.837 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.13 151.45 47.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.103 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 132.45 99.34 0.73 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.556 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -91.89 68.14 2.04 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.572 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.426 HG23 ' N ' ' A' ' 92' ' ' SER . 8.1 t -136.59 -47.37 0.62 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.742 0.306 . . . . 0.0 110.867 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.426 ' N ' HG23 ' A' ' 91' ' ' THR . 47.2 t -147.93 173.48 12.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.933 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.577 HG22 ' O ' ' A' ' 93' ' ' VAL . 14.9 p 42.1 44.0 0.33 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.83 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.59 53.64 4.57 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.57 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 30.3 m0 -97.19 61.12 1.71 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.943 0.402 . . . . 0.0 110.757 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -100.26 35.29 2.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.848 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 52.7 p -124.72 75.26 64.53 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.97 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.92 108.19 0.37 Allowed 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.556 2.171 . . . . 0.0 112.319 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.99 -26.64 83.52 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.433 2.088 . . . . 0.0 112.012 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -120.58 -176.09 3.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.002 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.5 t -166.95 61.38 0.61 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.063 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.496 ' O ' HD22 ' A' ' 103' ' ' LEU . 73.1 Cg_endo -74.75 60.37 5.21 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.587 2.191 . . . . 0.0 112.351 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.496 HD22 ' O ' ' A' ' 102' ' ' PRO . 4.2 mm? -123.22 97.7 5.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.927 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -161.52 116.67 2.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.852 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.37 160.1 43.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.945 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.413 ' N ' ' HD3' ' A' ' 107' ' ' PRO . 2.2 tt0 59.22 63.12 3.74 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.056 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.413 ' HD3' ' N ' ' A' ' 106' ' ' GLN . 31.3 Cg_exo -58.8 -41.39 63.39 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.507 2.138 . . . . 0.0 112.078 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -158.72 124.92 4.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.771 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.486 ' O ' ' HB1' ' A' ' 55' ' ' ALA . 0.5 OUTLIER -179.5 -61.53 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.995 -179.948 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.435 ' CD ' ' CB ' ' A' ' 109' ' ' SER . 56.2 Cg_endo -71.65 -167.17 0.28 Allowed 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.865 2.377 . . . . 0.0 112.326 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -131.09 65.87 0.59 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.65 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -57.71 -160.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.568 2.179 . . . . 0.0 112.16 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -127.57 78.04 75.27 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -52.36 92.56 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.606 2.204 . . . . 0.0 112.273 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.97 116.59 33.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.831 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -166.07 -56.58 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.862 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.47 -31.44 9.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.779 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.9 t 62.61 -80.99 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.028 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.51 141.15 33.77 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.913 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.603 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -58.99 179.61 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.084 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.59 82.8 2.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.928 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.412 ' CE1' ' HG1' ' A' ' 40' ' ' THR . 14.5 m-70 -76.18 135.62 39.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.829 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.558 HG11 ' HB2' ' A' ' 148' ' ' ALA . 21.5 t -138.62 120.77 17.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.116 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 5.6 m -59.69 151.38 25.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.858 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 37' ' ' ASP . 59.7 mt -109.32 38.08 2.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.899 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.93 34.23 4.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.833 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.561 ' HB2' ' HB3' ' A' ' 149' ' ' ALA . 10.5 ptt? 179.3 -36.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.044 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.85 -176.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.379 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.699 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.0 OUTLIER -167.44 125.79 1.28 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.472 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.586 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.2 p -94.19 159.18 2.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 121.255 0.55 . . . . 0.0 111.406 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' HG22 ' A' ' 130' ' ' VAL . 34.4 p -157.85 134.89 10.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.86 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 9.8 ttm105 -96.15 95.64 8.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.874 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -83.28 -177.06 6.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.95 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -139.85 155.12 47.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.953 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -99.09 152.3 37.73 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.904 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.97 -28.56 60.04 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.538 2.159 . . . . 0.0 112.484 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.4 p -95.19 -45.74 7.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.106 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.0 t0 59.99 73.82 0.62 Allowed Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.806 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.31 -45.11 5.77 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.587 2.192 . . . . 0.0 112.307 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.428 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.5 OUTLIER -174.88 -63.06 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.869 179.786 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.428 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 60.9 Cg_endo -72.68 119.25 5.98 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.522 2.148 . . . . 0.0 112.276 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 3.5 mmt180 -61.11 161.91 8.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.887 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -86.42 142.09 28.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.9 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.564 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.2 OUTLIER -121.0 140.55 51.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.794 179.892 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.435 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 6.0 tm-20 -148.68 126.49 11.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.826 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.782 HD11 HD13 ' A' ' 172' ' ' ILE . 29.6 mt -126.41 118.51 51.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.161 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 7.8 m -99.56 138.15 37.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.814 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.626 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -114.24 149.07 36.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.219 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.561 ' HB3' ' HB2' ' A' ' 127' ' ' MET . . . -95.14 30.4 2.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.286 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -115.23 45.03 1.71 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.186 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.3 22.73 3.37 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.132 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 58.1 61.06 2.45 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.17 0.51 . . . . 0.0 110.968 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.626 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.1 m-20 -87.43 157.67 19.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.911 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -156.47 90.93 1.2 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.119 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 7.3 m -84.61 118.66 32.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.233 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.435 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 70.2 m-85 -106.18 116.19 31.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.749 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 1.117 HD13 HD21 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -127.18 160.58 30.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.03 -179.742 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.457 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 5.2 tmm_? -135.78 94.11 3.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.811 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 1.023 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -54.92 172.35 0.11 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.366 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.07 -32.66 11.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.885 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -98.32 162.39 13.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.931 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.46 -51.64 6.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.955 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -69.07 -30.62 68.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 20.2 m -67.66 -52.84 33.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.652 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 1.023 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -61.34 -35.83 78.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.976 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -43.62 54.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.491 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 5.1 m -67.75 -30.15 69.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.046 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.575 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 5.4 m95 -71.28 -50.95 27.35 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.972 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.564 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -56.09 -51.52 67.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.325 0.583 . . . . 0.0 110.575 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -56.81 -41.03 90.63 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.58 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.21 -40.58 77.91 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.842 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.787 HG22 HD12 ' A' ' 176' ' ' ILE . 18.3 mt -60.07 -24.68 30.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.586 ' N ' HG11 ' A' ' 130' ' ' VAL . 4.2 tt0 -82.52 -28.35 31.14 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.255 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.11 -49.67 69.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.116 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -68.74 -41.07 79.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.75 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.787 HD12 HG22 ' A' ' 172' ' ' ILE . 91.7 mt -76.79 -7.55 10.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.282 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -86.13 25.52 6.88 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.481 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.5 t . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.866 179.998 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.809 0.338 . . . . 0.0 111.014 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -172.23 151.69 2.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.756 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 72.42 80.46 0.4 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.6 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.74 -174.59 2.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.714 0.293 . . . . 0.0 110.902 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.78 155.55 49.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.934 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.32 108.59 40.03 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.008 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.04 158.52 57.56 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.382 2.055 . . . . 0.0 112.284 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -79.39 141.04 37.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.775 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.8 p -139.17 138.8 37.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.058 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -146.18 127.25 2.72 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.418 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.2 mt -59.03 103.99 0.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.775 0.322 . . . . 0.0 110.985 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.467 HD22 ' CB ' ' A' ' 157' ' ' LEU . 0.1 OUTLIER -103.2 170.13 8.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.723 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -114.66 151.64 33.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.003 0.43 . . . . 0.0 111.123 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.408 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 1.2 tp -137.48 142.38 41.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.407 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.583 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.54 -178.07 1.35 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.887 0.375 . . . . 0.0 110.891 -179.547 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.9 t -174.16 103.77 0.11 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.985 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -106.12 -71.37 0.79 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.544 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 61.77 154.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.845 0.355 . . . . 0.0 111.118 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.5 -136.18 13.28 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.506 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.75 -67.54 0.85 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 0.0 110.854 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 173.55 39.48 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.459 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.35 163.87 21.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.812 0.339 . . . . 0.0 111.2 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -73.57 65.87 1.7 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.476 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -127.34 36.0 2.68 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.493 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -60.23 95.63 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.844 0.354 . . . . 0.0 110.782 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -92.14 77.66 5.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.898 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.583 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 12.8 m95 -59.42 95.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.829 179.813 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.85 179.11 6.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.907 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.4 ttp180 -112.32 133.41 54.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.895 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.85 HG12 ' HA ' ' A' ' 43' ' ' PRO . 27.7 m -139.54 120.91 15.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.206 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.9 tp -71.53 128.99 37.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.596 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.423 HD12 HG13 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -95.27 132.16 40.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.026 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -108.97 84.97 2.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.778 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.3 tp -82.0 108.88 15.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.997 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.58 146.39 44.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.022 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -61.5 -16.24 45.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.485 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -95.3 -25.51 16.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.994 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.437 ' HA ' HD22 ' A' ' 125' ' ' LEU . . . -179.07 178.52 0.73 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.917 0.389 . . . . 0.0 111.089 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.533 ' HB2' HD13 ' A' ' 125' ' ' LEU . 0.2 OUTLIER -123.07 113.12 18.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.801 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 56.5 m -116.8 134.16 55.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.942 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.474 HG12 ' N ' ' A' ' 42' ' ' SER . 11.1 t -115.8 159.77 15.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.17 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.474 ' N ' HG12 ' A' ' 41' ' ' VAL . 6.2 t -155.56 157.8 31.67 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.553 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.85 ' HA ' HG12 ' A' ' 30' ' ' VAL . 3.1 Cg_exo -75.24 44.43 1.2 Allowed 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.943 2.429 . . . . 0.0 112.725 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 45.28 30.04 0.62 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.917 0.389 . . . . 0.0 111.348 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -71.85 127.22 31.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.998 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -73.88 -159.25 5.94 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.499 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.09 122.47 81.34 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 120.506 0.193 . . . . 0.0 110.854 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.29 115.68 2.54 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.421 2.081 . . . . 0.0 112.375 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.43 ' N ' ' HD3' ' A' ' 50' ' ' PRO . . . -177.6 62.08 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.524 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.43 ' HD3' ' N ' ' A' ' 49' ' ' GLY . 24.3 Cg_exo -63.22 148.71 92.83 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.696 2.264 . . . . 0.0 112.261 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.408 ' CB ' ' CD ' ' A' ' 52' ' ' PRO . 9.8 mm-40 -83.54 -62.33 0.28 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.0 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.408 ' CD ' ' CB ' ' A' ' 51' ' ' GLU . 72.9 Cg_endo -76.46 160.75 35.12 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.461 2.107 . . . . 0.0 112.361 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -153.02 89.82 3.64 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.907 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.35 -172.91 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.566 2.177 . . . . 0.0 112.309 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -140.23 99.29 3.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.089 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 59.5 105.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.921 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -134.65 152.39 51.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.828 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -97.5 -45.77 6.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 138.03 153.43 6.27 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.414 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -79.96 152.55 29.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.775 0.321 . . . . 0.0 111.149 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -97.63 129.76 44.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.181 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -71.41 146.82 92.26 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.898 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.88 146.59 35.75 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.474 2.116 . . . . 0.0 112.343 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -113.76 -30.19 2.65 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.528 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -138.88 94.01 2.77 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.766 0.317 . . . . 0.0 111.037 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.423 ' HB1' ' HD2' ' A' ' 67' ' ' PRO . . . -151.77 156.88 34.59 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.023 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.423 ' HD2' ' HB1' ' A' ' 66' ' ' ALA . 56.0 Cg_endo -70.5 140.23 39.41 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.541 2.161 . . . . 0.0 112.246 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.39 76.27 3.6 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.451 2.101 . . . . 0.0 112.322 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -95.76 162.39 13.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.0 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.491 HD13 ' HD2' ' A' ' 71' ' ' PRO . 0.1 OUTLIER -82.0 111.35 26.26 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.804 179.911 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.491 ' HD2' HD13 ' A' ' 70' ' ' LEU . 43.5 Cg_endo -67.71 -168.6 0.19 Allowed 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.373 2.049 . . . . 0.0 112.445 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.515 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.3 mt-10 66.09 72.07 0.4 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.506 0.67 . . . . 0.0 110.762 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.515 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 170.64 -47.19 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.784 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.445 ' N ' HD12 ' A' ' 74' ' ' LEU . 8.2 mp -92.61 -31.4 15.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.9 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.611 ' C ' HD12 ' A' ' 75' ' ' LEU . 3.3 pp -73.76 -27.19 61.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.119 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.423 ' N ' HD12 ' A' ' 75' ' ' LEU . 0.8 OUTLIER -56.93 -30.78 64.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.911 -179.954 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.38 -27.72 63.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.81 -30.13 63.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.96 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -98.2 31.88 2.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.886 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.6 t -136.67 -64.66 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.044 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 61.91 151.74 0.1 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.926 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.49 58.36 5.17 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.605 2.204 . . . . 0.0 112.42 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -178.57 38.1 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.913 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -78.48 112.76 15.87 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.954 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -158.64 93.83 1.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.882 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -98.1 -32.44 11.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.853 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.02 150.29 36.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.853 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 63.81 130.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.081 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 65.26 170.64 2.79 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.497 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 132.81 149.3 6.16 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.477 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.7 t -95.67 157.29 15.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.867 0.365 . . . . 0.0 110.85 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 60.51 21.56 11.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.135 0.493 . . . . 0.0 111.214 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.554 ' O ' HG13 ' A' ' 93' ' ' VAL . 14.2 p -84.61 116.1 27.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.185 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 166.88 -86.12 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.484 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 60.46 97.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.836 0.351 . . . . 0.0 110.815 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -139.49 36.26 2.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.905 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.2 t -165.86 87.8 0.92 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.914 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -68.81 111.1 2.52 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.566 2.177 . . . . 0.0 112.289 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -79.64 -27.33 4.14 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.582 2.188 . . . . 0.0 112.226 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -147.53 124.54 11.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.106 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.4 p -73.79 158.14 86.46 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.876 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.55 106.54 0.15 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.599 2.199 . . . . 0.0 112.212 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 37.9 mt -99.02 -34.73 10.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -148.6 -178.63 6.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.929 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -120.0 -42.71 2.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.925 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -176.46 83.14 0.27 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.48 85.2 0.58 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.524 2.149 . . . . 0.0 112.357 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.5 m 62.2 118.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.959 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.43 ' CB ' ' CD ' ' A' ' 110' ' ' PRO . 0.4 OUTLIER 179.48 -60.75 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.904 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.43 ' CD ' ' CB ' ' A' ' 109' ' ' SER . 69.7 Cg_endo -75.15 142.9 27.96 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.909 2.406 . . . . 0.0 112.3 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -146.92 149.34 21.47 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.495 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.4 91.18 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.615 2.21 . . . . 0.0 112.223 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.465 ' N ' ' HD2' ' A' ' 114' ' ' PRO . 17.2 mm-40 -69.3 -55.81 9.36 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.105 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' PRO . . . . . 0.465 ' HD2' ' N ' ' A' ' 113' ' ' GLN . 73.6 Cg_endo -77.17 176.15 10.47 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.964 2.443 . . . . 0.0 112.33 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -140.7 31.81 1.84 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.924 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -75.17 -66.56 0.75 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.875 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.412 HD12 ' O ' ' A' ' 117' ' ' LEU . 4.2 pp -160.78 139.75 10.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.907 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -132.27 159.13 39.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.899 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 59.78 22.12 10.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.12 0.486 . . . . 0.0 111.14 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . 61.44 172.39 0.11 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.071 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.56 88.64 2.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.922 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 14.8 m-70 -85.8 139.53 31.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.062 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.47 HG12 ' H ' ' A' ' 125' ' ' LEU . 11.2 t -122.87 120.87 61.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.882 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.99 -28.31 16.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.317 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.533 HD13 ' HB2' ' A' ' 39' ' ' LEU . 1.2 tp 62.69 -174.38 0.15 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.754 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt 57.54 37.2 27.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.835 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.72 ' HG2' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -178.99 -36.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.925 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.631 ' HB3' HG13 ' A' ' 176' ' ' ILE . . . -56.08 -169.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.071 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.4 ' HA ' HG21 ' A' ' 176' ' ' ILE . 13.1 t80 -161.89 116.56 1.93 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.956 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.589 HG11 ' C ' ' A' ' 172' ' ' ILE . 1.4 p -97.08 158.69 3.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.184 0.516 . . . . 0.0 111.154 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.2 m -163.88 156.41 17.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.84 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 19.7 ttp-105 -122.54 93.67 4.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.978 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -123.93 169.57 11.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.72 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' CYS . . . . . 0.446 ' C ' HG22 ' A' ' 135' ' ' THR . 6.6 p -110.89 -177.91 3.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.955 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.662 HG23 ' CD ' ' A' ' 136' ' ' PRO . 0.5 OUTLIER -167.22 -63.19 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.939 179.847 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 136' ' ' PRO . . . . . 0.662 ' CD ' HG23 ' A' ' 135' ' ' THR . 33.3 Cg_endo -67.46 -68.3 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.114 1.876 . . . . 0.0 112.45 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 3.4 t 178.17 42.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.856 0.36 . . . . 0.0 110.704 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -55.04 107.5 0.89 Allowed Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.954 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -63.49 -66.86 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.5 2.133 . . . . 0.0 112.462 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.462 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 3.9 mm-40 -96.36 -66.06 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.532 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.462 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 58.9 Cg_endo -72.19 -167.41 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.241 1.96 . . . . 0.0 112.417 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.6 mtt85 -152.58 175.11 13.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.82 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.405 ' CE1' ' HD2' ' A' ' 158' ' ' ARG . 3.4 m-30 -82.97 119.77 24.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.937 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.808 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.5 OUTLIER -90.33 98.75 11.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.655 179.862 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.401 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 8.3 tm-20 -102.74 132.09 49.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.976 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.514 HG12 HG21 ' A' ' 172' ' ' ILE . 5.1 mp -135.74 111.58 12.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.906 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.5 m -100.6 134.09 44.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.873 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.754 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -108.11 145.31 34.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.283 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.72 ' HB3' ' HG2' ' A' ' 127' ' ' MET . . . -96.56 31.55 2.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.104 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -125.35 50.1 1.83 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.283 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 126.13 14.61 2.98 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.663 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 61.06 62.93 1.33 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.063 0.459 . . . . 0.0 110.896 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.754 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 81.0 m-20 -92.15 151.84 20.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.758 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.447 ' HB1' ' CE1' ' A' ' 156' ' ' PHE . . . -157.8 91.81 1.16 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.069 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 155' ' ' VAL . 14.0 m -94.36 115.73 33.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.301 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.447 ' CE1' ' HB1' ' A' ' 154' ' ' ALA . 8.8 m-85 -105.21 89.59 3.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.554 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.467 ' CB ' HD22 ' A' ' 12' ' ' LEU . 1.1 mt -104.88 167.96 9.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.302 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.469 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 14.7 ttt-85 -127.43 103.16 7.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.616 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.909 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.01 173.57 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.294 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -77.49 -69.54 0.53 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.068 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -110.25 177.6 4.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.04 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.85 -42.65 66.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.011 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -63.75 -50.86 67.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.982 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -46.58 88.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.591 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.909 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -61.29 -37.4 83.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.962 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.4 -47.9 58.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.443 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 56.3 m -64.7 -33.1 75.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.067 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.456 ' O ' HD12 ' A' ' 172' ' ' ILE . 11.7 m95 -73.61 -50.8 19.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.712 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.808 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -57.15 -46.48 82.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.286 0.565 . . . . 0.0 110.474 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -60.49 -43.09 99.18 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.768 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.82 -40.37 72.48 Favored 'General case' 0 CA--C 1.509 -0.615 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.805 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.765 ' O ' HD13 ' A' ' 176' ' ' ILE . 11.8 mt -60.95 -23.73 30.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.561 ' N ' HG11 ' A' ' 130' ' ' VAL . 17.7 tt0 -78.87 -40.69 31.78 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.481 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 174' ' ' ALA . . . . . 0.456 ' HA ' HG22 ' A' ' 178' ' ' THR . . . -64.5 -46.18 84.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.43 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.07 -39.01 89.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.023 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.765 HD13 ' O ' ' A' ' 172' ' ' ILE . 1.2 mp -60.07 -36.05 65.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.592 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 129.9 56.05 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.46 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 178' ' ' THR . . . . . 0.509 ' OXT' HG23 ' A' ' 178' ' ' THR . 4.4 t . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.035 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.808 0.337 . . . . 0.0 111.075 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.23 178.84 5.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.844 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 127.51 57.48 0.13 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.495 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -156.74 -61.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.829 0.347 . . . . 0.0 110.913 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -151.85 127.16 9.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.926 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -148.25 136.26 11.13 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.085 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.19 159.36 49.97 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.508 2.139 . . . . 0.0 112.386 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -85.41 140.91 30.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.634 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.727 HG22 ' HA ' ' A' ' 33' ' ' SER . 70.4 p -137.24 147.28 45.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.849 0.357 . . . . 0.0 111.191 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -152.55 123.16 1.41 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.356 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 35.0 mt -56.39 102.87 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.829 0.347 . . . . 0.0 111.03 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.872 HD13 HD22 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -112.63 151.65 29.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.716 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -95.23 146.58 24.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.873 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.447 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 14.8 tp -125.03 142.94 51.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.45 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.481 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 19.1 ttp180 -69.41 160.66 30.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.576 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.406 ' HB3' ' CB ' ' A' ' 26' ' ' ARG . 33.7 t -143.4 38.82 1.4 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.917 0.389 . . . . 0.0 110.984 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -157.51 27.47 0.48 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.492 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -110.33 57.01 0.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.061 0.457 . . . . 0.0 111.114 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -122.8 -61.15 0.2 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.497 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m -153.85 134.21 13.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.786 0.327 . . . . 0.0 110.955 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 90.62 -145.23 17.83 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.513 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -173.58 147.33 1.41 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.836 0.35 . . . . 0.0 111.048 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.76 41.34 3.14 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.49 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.01 51.72 0.54 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.46 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -70.36 121.11 17.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.859 0.362 . . . . 0.0 111.015 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.406 ' CB ' ' HB3' ' A' ' 16' ' ' CYS . 40.9 mtp180 -141.46 47.42 1.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.803 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.481 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.8 m95 -49.14 115.03 1.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.148 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -97.97 178.65 5.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.983 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.4 HH11 ' HB1' ' A' ' 44' ' ' ALA . 2.0 tmm_? -105.94 129.95 53.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.845 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.733 HG12 ' HA ' ' A' ' 43' ' ' PRO . 32.6 m -144.46 123.51 6.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.358 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.5 tp -69.72 120.96 16.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.503 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 1.009 HD12 HG13 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -88.12 109.2 19.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.962 -179.929 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.727 ' HA ' HG22 ' A' ' 9' ' ' THR . 44.1 t -85.01 84.43 7.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.688 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.673 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 4.1 tp -78.74 125.9 30.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.306 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -129.95 141.65 50.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.928 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -63.03 -14.8 52.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.52 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -101.8 -19.89 15.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.108 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.518 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -173.5 172.08 3.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.878 0.37 . . . . 0.0 111.068 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.451 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -121.66 107.86 12.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.809 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -113.69 141.4 47.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.155 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 1.009 HG13 HD12 ' A' ' 32' ' ' LEU . 2.5 t -118.41 152.92 20.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.012 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.4 t -149.05 149.93 31.02 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.541 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.733 ' HA ' HG12 ' A' ' 30' ' ' VAL . 60.4 Cg_endo -72.69 47.5 1.19 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.582 2.188 . . . . 0.0 112.838 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.4 ' HB1' HH11 ' A' ' 29' ' ' ARG . . . 45.19 30.09 0.6 Allowed 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.9 0.381 . . . . 0.0 111.408 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -121.4 108.08 13.25 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.025 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -91.6 143.23 16.46 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.486 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 43.19 84.37 0.19 Allowed Pre-proline 0 N--CA 1.464 0.243 0 CA-C-O 120.705 0.288 . . . . 0.0 111.403 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.9 125.26 13.9 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.51 2.14 . . . . 0.0 112.334 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -141.25 100.34 0.26 Allowed Glycine 0 CA--C 1.52 0.346 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.406 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -50.06 161.04 1.12 Allowed 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.612 2.208 . . . . 0.0 112.396 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -154.68 139.51 11.83 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.847 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.38 88.71 0.98 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.578 2.185 . . . . 0.0 112.278 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -60.7 160.51 19.07 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.933 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.59 125.83 18.31 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.613 2.209 . . . . 0.0 112.223 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.83 129.6 42.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.246 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 58.92 29.75 19.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.936 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.51 ' N ' HD12 ' A' ' 57' ' ' LEU . 6.7 mp 58.62 166.45 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.931 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -100.31 99.3 9.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.971 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 115.1 166.97 15.24 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.431 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.83 -171.56 0.1 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.789 0.328 . . . . 0.0 111.129 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -137.37 152.06 49.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.207 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.631 ' HB2' ' HB2' ' A' ' 66' ' ' ALA . 10.8 pt-20 43.59 64.28 6.96 Favored Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.508 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.423 ' HD3' ' N ' ' A' ' 62' ' ' GLU . 21.4 Cg_exo -65.32 142.86 74.65 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.615 2.21 . . . . 0.0 112.218 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.44 -80.37 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.699 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -116.08 174.46 6.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.849 0.357 . . . . 0.0 111.24 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.631 ' HB2' ' HB2' ' A' ' 62' ' ' GLU . . . -154.21 69.18 6.11 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.975 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.28 105.88 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.719 2.279 . . . . 0.0 112.399 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -71.87 100.91 1.12 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.418 2.078 . . . . 0.0 112.28 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -142.06 159.72 41.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.975 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 90.7 mt -60.14 163.23 8.46 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.963 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.425 ' HB3' HD11 ' A' ' 75' ' ' LEU . 35.4 Cg_exo -59.38 -154.23 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.489 2.126 . . . . 0.0 112.249 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.561 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 1.9 mt-10 66.03 71.32 0.41 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.389 0.614 . . . . 0.0 110.746 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.561 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 165.18 -35.03 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.415 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.3 pp -96.24 -33.99 11.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.834 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.425 HD11 ' HB3' ' A' ' 71' ' ' PRO . 4.2 mp -66.66 -26.46 67.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.04 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.745 HD22 ' O ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -94.25 -47.1 6.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.542 -179.974 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.725 ' N ' HD13 ' A' ' 76' ' ' LEU . 5.5 mt-30 -80.41 80.97 6.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.863 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -98.91 -60.14 1.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.727 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -98.28 60.07 1.38 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.86 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.5 t -138.7 -47.06 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.046 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.485 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -66.0 -49.98 54.52 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.177 179.943 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 81' ' ' SER . 45.2 Cg_endo -93.45 -141.15 0.02 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.664 2.909 . . . . 0.0 111.708 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.426 ' H ' ' HB2' ' A' ' 82' ' ' PRO . 35.3 t80 -121.64 130.41 53.46 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.83 0.347 . . . . 0.0 110.917 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -173.35 87.73 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.824 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.92 -53.32 2.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.887 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -139.62 94.47 2.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.944 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -105.28 136.36 44.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.897 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -123.52 -43.22 2.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.074 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 130.67 -164.56 23.05 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.537 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -145.38 -45.02 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.497 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.8 t -67.4 160.91 26.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.753 0.311 . . . . 0.0 110.943 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.9 m -115.77 141.41 48.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.952 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.2 p -65.92 142.21 17.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.078 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 101.06 -34.01 5.98 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.479 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.4 m95 -114.48 65.07 0.67 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.888 0.375 . . . . 0.0 110.872 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -173.21 50.59 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.808 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.8 t -155.2 111.88 2.28 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.783 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -68.21 157.13 63.12 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.428 2.085 . . . . 0.0 112.319 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.21 -27.59 24.12 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.597 2.198 . . . . 0.0 112.347 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -106.93 98.57 8.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.074 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 25.0 m -93.9 154.41 40.81 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.93 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.94 167.06 25.76 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.619 2.213 . . . . 0.0 112.261 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -104.42 82.91 1.98 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.923 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 58.01 104.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.971 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 4.8 ttt85 -151.91 154.96 37.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.85 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.6 142.33 24.41 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.866 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -55.89 -166.41 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.39 2.06 . . . . 0.0 112.345 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -150.41 33.57 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.811 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 87.4 p -108.53 125.24 32.26 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.873 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.31 -167.88 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.433 2.089 . . . . 0.0 112.339 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 64.56 115.98 0.01 OUTLIER Glycine 0 CA--C 1.519 0.302 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.471 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.94 -177.11 0.41 Allowed 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.452 2.101 . . . . 0.0 112.431 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -81.09 142.95 52.05 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.865 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.89 59.81 5.88 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.539 2.159 . . . . 0.0 112.262 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 59.0 ttp180 -147.1 157.59 43.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.84 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -158.32 50.76 0.4 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.864 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.418 HD22 ' HD3' ' A' ' 43' ' ' PRO . 0.5 OUTLIER -162.43 -44.16 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.983 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 26.5 t 62.89 -80.98 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.991 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.0 134.3 33.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.833 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.96 -175.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.995 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.506 ' HE2' HG12 ' A' ' 155' ' ' VAL . 6.3 mttp -131.79 82.99 2.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.009 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -82.49 150.87 26.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.961 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.497 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 18.7 t -150.37 159.34 4.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.022 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.499 ' O ' HD22 ' A' ' 125' ' ' LEU . 0.7 OUTLIER -82.2 171.54 14.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.048 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.518 HD23 ' HA ' ' A' ' 38' ' ' ALA . 0.7 OUTLIER -134.63 31.54 3.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.825 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.41 ' HD2' HG21 ' A' ' 178' ' ' THR . 0.2 OUTLIER -148.82 41.91 0.94 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.909 179.91 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.5 ttm 178.89 -36.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.939 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.12 -165.96 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.251 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.479 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.1 OUTLIER -168.61 137.76 2.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.66 -179.979 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.623 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -110.25 158.89 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.314 0.578 . . . . 0.0 111.484 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.3 m -163.67 151.43 12.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.473 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 11.8 ptt-85 -123.57 91.76 3.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.879 0.371 . . . . 0.0 111.171 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -81.83 175.15 10.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.703 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 1.1 t -135.52 147.87 48.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.832 0.348 . . . . 0.0 111.016 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 73.3 p -119.96 154.22 55.38 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.823 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -54.54 -22.69 28.91 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.56 2.173 . . . . 0.0 112.449 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 22.0 p -88.46 -37.61 15.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.839 0.352 . . . . 0.0 111.179 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -79.29 112.63 29.89 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.992 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -88.76 -72.73 0.0 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 122.796 2.331 . . . . 0.0 112.421 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.411 ' N ' ' HD2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER -73.43 -62.33 1.22 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.175 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' A' ' 140' ' ' GLU . 29.9 Cg_endo -63.58 173.5 4.43 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.513 2.142 . . . . 0.0 112.332 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -141.03 158.6 43.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.985 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -79.82 101.41 8.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.89 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.565 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.4 OUTLIER -76.29 105.07 7.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.891 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.425 ' HG3' ' CZ ' ' A' ' 156' ' ' PHE . 0.1 OUTLIER -111.0 130.66 55.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.629 HD11 ' CD1' ' A' ' 172' ' ' ILE . 24.5 mt -129.98 115.63 34.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.075 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 2.9 m -95.2 136.7 35.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.953 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.574 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -116.83 148.58 41.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.175 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.59 30.55 1.98 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.357 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.27 44.51 1.68 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.114 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 118.84 22.2 3.66 Favored Glycine 0 N--CA 1.452 -0.282 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.107 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 58.89 62.05 1.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.123 0.487 . . . . 0.0 110.818 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.574 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 1.2 m-20 -90.63 162.27 15.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.882 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.21 94.21 0.81 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.069 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.506 HG12 ' HE2' ' A' ' 121' ' ' LYS . 32.9 m -87.07 120.23 36.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.328 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.425 ' CZ ' ' HG3' ' A' ' 145' ' ' GLU . 0.3 OUTLIER -104.18 90.03 3.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.75 179.868 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.482 ' CB ' HD22 ' A' ' 12' ' ' LEU . 1.2 mt -102.75 168.96 8.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.961 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 158' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -137.44 103.35 5.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.838 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 1.054 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -57.53 173.49 0.27 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.5 tttp -79.86 -71.41 0.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.989 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -85.08 170.89 12.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.873 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -81.04 -35.56 31.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.948 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -73.33 -40.14 64.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.953 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.11 -41.4 90.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.43 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 1.054 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -64.76 -42.97 94.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.767 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.9 mtt180 -70.43 -43.97 68.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.225 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -34.53 77.84 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.327 0.584 . . . . 0.0 109.502 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.673 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -68.68 -59.83 2.84 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.595 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.565 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -47.13 -57.61 4.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.161 0.505 . . . . 0.0 110.881 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.46 -39.0 58.97 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.438 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -67.66 -41.61 83.51 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.152 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.927 HG22 HD12 ' A' ' 176' ' ' ILE . 12.7 mt -62.0 -23.29 31.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 177.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.623 ' N ' HG11 ' A' ' 130' ' ' VAL . 7.0 tt0 -81.17 -28.55 34.95 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.265 179.365 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.92 -45.12 75.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.375 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 175' ' ' GLN . . . . . 0.441 ' HB2' HD11 ' A' ' 125' ' ' LEU . 18.7 mt-30 -74.87 -34.44 62.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.188 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.927 HD12 HG22 ' A' ' 172' ' ' ILE . 82.8 mt -85.77 -7.36 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.33 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -85.85 25.09 6.95 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.515 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' THR . . . . . 0.41 HG21 ' HD2' ' A' ' 126' ' ' LYS . 2.6 t . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.919 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 120.936 0.398 . . . . 0.0 111.048 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -71.65 174.49 6.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.861 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -170.46 -83.06 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.517 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.59 -74.05 0.62 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.811 0.338 . . . . 0.0 110.851 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.82 147.01 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.918 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -101.48 142.63 24.99 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.015 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -63.83 152.34 81.12 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.626 2.218 . . . . 0.0 112.272 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -84.15 152.53 24.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.943 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.756 HG22 ' HA ' ' A' ' 33' ' ' SER . 70.7 p -142.55 142.91 32.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.95 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -150.75 132.0 3.75 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.415 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.71 HD22 ' HD3' ' A' ' 29' ' ' ARG . 11.4 mt -64.84 119.45 10.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.871 0.367 . . . . 0.0 111.04 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 157' ' ' LEU . 0.1 OUTLIER -134.33 158.8 42.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.787 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.63 ' O ' HD23 ' A' ' 157' ' ' LEU . 1.4 mm-40 -92.5 157.75 16.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.969 0.414 . . . . 0.0 110.985 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.4 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 14.3 tp -134.81 130.29 35.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.659 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.488 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 12.9 ttp180 -69.57 168.86 13.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.655 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 26' ' ' ARG . 9.2 t -143.37 157.4 44.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.901 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 140.18 -100.25 0.27 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.54 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 60.96 179.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.834 0.349 . . . . 0.0 111.122 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.27 86.1 1.55 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.737 -0.745 . . . . 0.0 112.513 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.2 t -166.1 83.8 0.3 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.856 0.36 . . . . 0.0 110.867 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 90.37 -72.11 2.01 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.514 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -154.48 155.74 35.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.909 0.385 . . . . 0.0 111.052 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -134.48 70.0 0.52 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.415 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -94.39 23.21 33.03 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.669 -0.776 . . . . 0.0 112.644 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 60.41 112.18 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.802 0.334 . . . . 0.0 111.014 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.449 ' HD3' ' HG2' ' A' ' 72' ' ' GLU . 10.2 ttp-105 -140.95 65.0 1.41 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.84 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.488 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.7 m95 -50.41 173.9 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.994 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -169.28 166.78 10.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.875 0.369 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.71 ' HD3' HD22 ' A' ' 11' ' ' LEU . 7.6 tmm_? -90.81 130.5 36.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.853 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.713 HG12 ' HA ' ' A' ' 43' ' ' PRO . 34.6 m -149.93 125.13 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.367 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 tp -69.8 135.1 49.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.625 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.552 ' HG ' HG22 ' A' ' 41' ' ' VAL . 1.3 mp -103.93 113.97 27.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.964 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.756 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.9 OUTLIER -86.71 81.14 8.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.766 179.861 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.63 HD12 HD21 ' A' ' 39' ' ' LEU . 3.6 tp -73.7 117.08 15.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.105 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.434 ' O ' HD22 ' A' ' 125' ' ' LEU . . . -121.97 138.95 54.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.964 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.88 -23.9 47.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.222 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.33 -31.93 22.74 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.975 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.428 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -172.67 174.22 3.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.205 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.63 HD21 HD12 ' A' ' 34' ' ' LEU . 1.2 mt -111.26 115.32 29.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.864 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 63.9 m -120.27 130.74 54.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.841 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.641 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 14.7 t -111.86 159.34 11.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.169 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.473 ' N ' HG12 ' A' ' 41' ' ' VAL . 6.0 t -155.65 153.34 26.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.495 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.713 ' HA ' HG12 ' A' ' 30' ' ' VAL . 13.7 Cg_exo -69.41 50.68 0.73 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.736 2.291 . . . . 0.0 112.695 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 43.66 30.62 0.38 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.875 0.369 . . . . 0.0 111.438 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.78 101.61 12.95 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.935 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -70.2 125.28 14.83 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.396 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 60.49 92.68 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 120.665 0.269 . . . . 0.0 110.806 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.64 178.8 2.48 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.45 2.1 . . . . 0.0 112.379 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -123.95 93.1 0.46 Allowed Glycine 0 CA--C 1.518 0.255 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.532 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -68.93 -12.25 33.92 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.636 2.224 . . . . 0.0 112.544 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.461 ' CB ' ' CD ' ' A' ' 52' ' ' PRO . 2.8 mt-10 -160.06 -65.69 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.922 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 51' ' ' GLU . 57.5 Cg_endo -71.0 -169.23 0.38 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.326 2.017 . . . . 0.0 112.188 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -119.17 122.74 29.31 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.804 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.71 115.2 4.2 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.351 2.034 . . . . 0.0 112.333 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.02 155.24 20.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.145 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -124.63 136.41 53.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.916 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.5 mt -87.54 130.19 34.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.911 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -144.4 104.27 4.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.864 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -105.97 -71.59 0.8 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.466 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -110.66 102.64 11.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.821 0.343 . . . . 0.0 111.02 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.1 163.03 20.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.166 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -86.57 108.16 16.82 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.914 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.95 95.85 0.43 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.491 2.128 . . . . 0.0 112.332 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -170.94 91.55 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.47 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -145.55 99.83 3.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.915 0.388 . . . . 0.0 111.029 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.827 ' HB3' ' HD3' ' A' ' 67' ' ' PRO . . . -72.97 -59.65 2.13 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.254 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.827 ' HD3' ' HB3' ' A' ' 66' ' ' ALA . 73.9 Cg_endo -76.32 137.01 18.41 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 122.867 2.378 . . . . 0.0 112.282 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 67' ' ' PRO . 35.6 Cg_exo -57.6 83.12 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.41 2.073 . . . . 0.0 112.248 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.06 154.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.946 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.817 HD13 ' HD2' ' A' ' 71' ' ' PRO . 0.2 OUTLIER -99.81 119.76 58.94 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.784 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.817 ' HD2' HD13 ' A' ' 70' ' ' LEU . 40.6 Cg_endo -66.86 -171.66 0.28 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.462 2.108 . . . . 0.0 112.39 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.577 ' HA ' HD11 ' A' ' 75' ' ' LEU . 1.2 mt-10 68.87 74.24 0.26 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.476 0.655 . . . . 0.0 110.836 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 168.33 -50.92 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.537 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.52 -35.37 15.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.63 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.72 HD12 ' N ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -66.13 -14.99 62.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.421 179.898 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.72 ' N ' HD12 ' A' ' 75' ' ' LEU . 0.1 OUTLIER -58.84 -30.73 67.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.844 0.354 . . . . 0.0 110.958 -179.943 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.509 ' HB3' HG21 ' A' ' 80' ' ' VAL . 36.5 mt-30 -77.82 64.12 3.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.812 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.37 -23.32 26.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.172 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -96.32 30.98 2.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.094 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.509 HG21 ' HB3' ' A' ' 77' ' ' GLN . 20.6 t -118.07 -29.34 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.387 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.453 ' N ' ' HD2' ' A' ' 82' ' ' PRO . 0.1 OUTLIER -54.86 -54.77 45.95 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.34 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' A' ' 81' ' ' SER . 73.0 Cg_endo -78.05 56.07 5.57 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 122.91 2.406 . . . . 0.0 112.647 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 61.32 123.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.157 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -171.14 102.67 0.21 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.848 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.54 70.17 0.64 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.817 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -135.29 129.75 34.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.859 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 32.8 t -130.61 -68.44 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.933 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 60.01 173.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.075 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 160.16 -51.96 0.36 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.47 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 65.69 -107.18 1.82 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.461 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.773 HG21 ' HA ' ' A' ' 99' ' ' PRO . 4.1 t -176.38 156.17 1.53 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.841 0.353 . . . . 0.0 110.928 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.3 p -138.47 139.95 39.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.836 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.45 ' O ' HG13 ' A' ' 93' ' ' VAL . 12.5 p -71.66 123.02 25.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.145 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -155.36 -55.54 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.454 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 41.8 p90 -109.35 41.01 1.73 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.853 0.359 . . . . 0.0 110.771 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.1 t70 61.78 35.45 16.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.934 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.45 129.91 45.53 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.861 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.58 131.35 14.71 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.481 2.121 . . . . 0.0 112.358 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.773 ' HA ' HG21 ' A' ' 91' ' ' THR . 61.0 Cg_endo -72.82 -25.6 16.68 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.385 2.057 . . . . 0.0 112.298 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.57 122.32 12.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.202 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 95.5 p -138.25 115.6 9.26 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.885 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -58.06 122.48 11.78 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.547 2.164 . . . . 0.0 112.298 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.7 mt -132.57 132.15 42.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.925 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -95.74 119.53 34.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.865 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -113.46 -32.32 6.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.062 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 63.66 89.1 0.11 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.866 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -51.56 -54.75 4.82 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.634 2.223 . . . . 0.0 112.391 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.3 m -59.66 -172.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.963 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.9 m 62.98 144.66 0.08 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.014 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.92 146.08 36.95 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.555 2.17 . . . . 0.0 112.349 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -109.6 -69.95 0.64 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.449 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.01 146.91 35.43 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.56 2.173 . . . . 0.0 112.288 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.16 89.43 0.11 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.813 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -68.49 -168.63 0.23 Allowed 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.538 2.159 . . . . 0.0 112.304 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 20.3 mtm180 -75.53 106.43 7.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.899 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.427 ' O ' ' CB ' ' A' ' 117' ' ' LEU . 24.7 m-80 -80.75 153.03 28.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.828 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.56 HD23 ' O ' ' A' ' 119' ' ' GLU . 0.2 OUTLIER 83.2 -38.5 0.08 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.561 -179.847 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 24.9 t 68.01 -72.13 0.1 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.801 0.334 . . . . 0.0 111.098 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.56 ' O ' HD23 ' A' ' 117' ' ' LEU . 29.3 tt0 -95.72 154.97 16.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.88 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.641 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -85.67 169.96 12.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.089 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.32 159.74 15.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.802 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -147.67 135.28 20.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.881 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.756 HG13 ' HB2' ' A' ' 148' ' ' ALA . 19.7 t -139.68 140.15 37.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.135 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.01 135.74 37.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.832 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.434 HD22 ' O ' ' A' ' 35' ' ' ALA . 3.2 mp -99.19 31.49 3.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.864 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.833 ' HG2' HG21 ' A' ' 178' ' ' THR . 6.3 mttm -139.41 38.12 2.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.739 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.737 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 2.3 mtt 179.27 -35.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.063 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.8 -165.97 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.322 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -170.04 113.67 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.665 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.576 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.0 p -88.14 158.8 3.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.322 0.582 . . . . 0.0 111.439 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 2.6 m -164.65 149.78 9.84 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.801 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 7.0 ptt85 -126.67 104.04 7.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.012 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.15 156.01 17.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.753 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 61.1 m -81.83 141.02 33.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.912 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.405 ' HB ' ' HD2' ' A' ' 136' ' ' PRO . 0.1 OUTLIER -76.23 170.34 16.52 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.759 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 136' ' ' PRO . . . . . 0.405 ' HD2' ' HB ' ' A' ' 135' ' ' THR . 70.3 Cg_exo -50.68 -27.88 21.0 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.618 2.212 . . . . 0.0 112.445 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -126.82 -43.9 1.68 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.957 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.1 81.97 0.23 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.879 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.92 -24.5 24.29 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.576 2.184 . . . . 0.0 112.418 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.427 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 1.5 mt-10 -175.31 -62.44 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.804 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 44.4 Cg_endo -68.07 178.49 3.5 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.463 2.108 . . . . 0.0 112.225 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 9.2 mtt-85 -123.59 152.59 41.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.888 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -73.97 100.92 3.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.949 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.469 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.8 OUTLIER -82.83 138.1 34.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.949 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.416 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.0 OUTLIER -153.66 139.91 18.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.82 179.952 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 24.9 mt -134.1 125.1 47.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.241 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.47 126.18 49.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.78 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.857 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -102.78 145.53 29.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.361 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.737 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -96.75 30.65 2.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.171 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -118.61 46.07 1.91 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.38 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.39 23.11 2.69 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.356 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 58.43 60.66 2.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.126 0.489 . . . . 0.0 110.94 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.857 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 0.6 OUTLIER -90.16 160.65 16.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.9 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.23 94.03 0.8 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.078 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 6.9 m -89.48 112.67 24.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.246 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.416 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 15.6 m-85 -97.2 115.99 28.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.731 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.63 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.4 mt -125.66 165.61 18.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.078 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.459 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.1 OUTLIER -140.43 96.81 3.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.748 179.863 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.951 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -57.33 162.88 2.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.203 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.98 -32.23 17.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.924 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -98.13 164.27 12.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.822 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -88.65 -55.8 3.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.91 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.81 85.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.159 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 1.8 t -63.97 -48.16 77.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.79 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.951 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -60.12 -38.61 83.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.011 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 74.3 mtp180 -71.12 -47.33 58.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.436 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.06 -28.4 69.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.176 179.237 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.6 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -72.44 -52.07 17.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.908 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.469 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -56.9 -47.62 80.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.304 0.573 . . . . 0.0 110.53 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.96 -43.12 97.04 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.64 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.95 -40.72 78.76 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.997 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.795 HG22 HD12 ' A' ' 176' ' ' ILE . 19.1 mt -60.21 -24.63 31.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.576 ' N ' HG11 ' A' ' 130' ' ' VAL . 30.6 tt0 -83.84 -27.0 29.03 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.324 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.56 -47.98 68.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.141 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -69.96 -42.09 73.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.86 179.038 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.795 HD12 HG22 ' A' ' 172' ' ' ILE . 75.9 mt -77.57 -8.94 12.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.36 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -85.89 25.67 6.57 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.393 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' THR . . . . . 0.833 HG21 ' HG2' ' A' ' 126' ' ' LYS . 3.6 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.858 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.859 0.361 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -168.65 84.73 0.17 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.894 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.06 36.6 90.92 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.609 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -119.22 86.31 2.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.817 0.341 . . . . 0.0 110.957 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -68.45 102.86 1.52 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.864 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -110.13 92.6 13.48 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.166 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -68.09 152.87 76.09 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.584 2.19 . . . . 0.0 112.297 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.647 ' CG ' HD23 ' A' ' 34' ' ' LEU . 4.4 ptt180 -101.25 139.18 37.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.952 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.628 HG22 ' HA ' ' A' ' 33' ' ' SER . 14.0 p -129.36 167.98 16.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.02 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -167.05 132.75 2.7 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.48 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.5 103.22 0.63 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.762 0.315 . . . . 0.0 110.895 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -120.19 146.69 45.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.811 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.492 ' O ' HD23 ' A' ' 157' ' ' LEU . 4.1 mm-40 -70.64 169.84 13.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.922 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.422 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 37.6 tp -157.57 130.42 7.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.697 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.483 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.57 -171.65 0.4 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.635 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.6 t -178.29 101.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.905 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -150.87 -176.52 23.85 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.413 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -162.8 90.31 0.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.837 0.351 . . . . 0.0 111.092 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 128.93 -45.43 1.14 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.618 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.2 m -100.61 141.82 32.94 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.833 0.349 . . . . 0.0 110.838 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.92 -32.72 4.92 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.482 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -153.34 30.74 0.48 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.81 0.338 . . . . 0.0 111.089 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -120.53 33.46 4.47 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.472 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.16 104.95 2.96 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.471 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -140.07 174.84 10.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.768 0.318 . . . . 0.0 110.952 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.405 ' O ' ' CD1' ' A' ' 27' ' ' TRP . 0.2 OUTLIER -97.88 173.75 6.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.939 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.483 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 17.1 m95 -154.82 173.64 16.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.929 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -178.09 168.45 1.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.926 0.393 . . . . 0.0 110.844 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -95.09 129.02 42.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.866 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 27.7 m -136.65 138.39 46.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.177 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 17.4 tp -74.33 123.44 24.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.658 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.776 HD12 HG13 ' A' ' 41' ' ' VAL . 0.4 OUTLIER -98.04 114.49 26.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.108 -179.833 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.628 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.9 OUTLIER -94.47 85.74 4.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.575 179.657 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.732 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 2.5 tp -84.93 103.7 14.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.136 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.639 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -91.21 155.96 18.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.706 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -57.43 -16.73 10.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.816 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.06 28.95 1.1 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.432 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.69 ' CA ' HD23 ' A' ' 125' ' ' LEU . . . 179.55 114.75 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.858 0.361 . . . . 0.0 111.514 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.543 HD13 HD12 ' A' ' 34' ' ' LEU . 17.2 tp -95.92 82.44 3.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.397 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.489 HG21 ' CE1' ' A' ' 122' ' ' HIS . 27.6 m -92.49 114.19 26.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.204 -179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.776 HG13 HD12 ' A' ' 32' ' ' LEU . 8.0 t -83.41 157.35 3.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.675 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.411 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -159.9 163.09 23.42 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.906 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.455 ' HD3' HD22 ' A' ' 117' ' ' LEU . 56.0 Cg_endo -70.35 147.41 59.0 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.534 2.156 . . . . 0.0 112.133 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -95.83 43.56 1.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.984 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.3 p30 44.82 37.12 2.13 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.513 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -78.22 136.35 17.86 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.438 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -145.61 154.26 52.1 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.683 0.278 . . . . 0.0 110.91 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -62.16 179.03 0.67 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.528 2.152 . . . . 0.0 112.208 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.425 ' N ' ' HD2' ' A' ' 50' ' ' PRO . . . 168.75 -56.64 0.21 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.548 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' A' ' 49' ' ' GLY . 60.9 Cg_endo -72.98 -6.05 18.3 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.545 2.163 . . . . 0.0 112.694 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.55 96.36 4.45 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.833 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.94 111.85 2.54 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.409 2.073 . . . . 0.0 112.354 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -123.29 124.0 26.47 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.84 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.48 154.09 65.16 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.375 2.05 . . . . 0.0 112.325 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -149.48 -176.49 5.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.074 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.673 ' C ' HD23 ' A' ' 57' ' ' LEU . 0.9 OUTLIER 64.55 -78.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.945 179.988 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.673 HD23 ' C ' ' A' ' 56' ' ' GLN . 1.0 OUTLIER 42.44 43.93 3.28 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.508 179.897 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -62.65 113.07 2.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 153.07 97.24 0.15 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.521 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.29 96.45 9.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.83 0.348 . . . . 0.0 111.149 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -157.58 124.5 5.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.091 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 59.78 82.34 0.23 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.921 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.19 162.76 1.86 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.553 2.169 . . . . 0.0 112.289 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -176.34 -52.97 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.451 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -81.49 94.67 6.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.779 0.323 . . . . 0.0 111.064 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.861 ' HB3' ' HD3' ' A' ' 67' ' ' PRO . . . -114.8 -68.53 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.542 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.861 ' HD3' ' HB3' ' A' ' 66' ' ' ALA . 58.4 Cg_endo -72.24 111.41 3.19 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.751 2.301 . . . . 0.0 112.409 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.15 -161.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.495 2.13 . . . . 0.0 112.385 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.492 ' C ' HD22 ' A' ' 70' ' ' LEU . 45.7 mt-30 -96.2 176.25 6.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.079 179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.492 HD22 ' C ' ' A' ' 69' ' ' GLN . 4.4 mm? -118.66 83.82 23.11 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.942 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.5 -167.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.635 2.223 . . . . 0.0 112.275 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.489 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 1.3 mt-10 66.01 72.05 0.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.376 0.607 . . . . 0.0 110.801 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.489 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 172.06 -46.53 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.736 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.94 -31.34 17.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.775 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.585 ' H ' HD12 ' A' ' 75' ' ' LEU . 4.0 mp -74.27 -37.24 63.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.985 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.8 mp -61.15 -34.45 75.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.936 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 62.1 mm-40 -97.82 32.45 2.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.012 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -107.55 -0.2 22.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.421 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -98.29 31.96 2.63 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.82 0.343 . . . . 0.0 111.03 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 38.8 t -143.62 -72.13 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.152 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.6 t 61.72 148.32 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.912 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -83.44 48.38 2.64 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.69 2.26 . . . . 0.0 112.524 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -177.52 37.42 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.954 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.408 ' O ' ' CD1' ' A' ' 84' ' ' PHE . 52.9 p90 -74.64 123.14 24.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -114.15 171.17 7.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -108.95 92.99 4.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.906 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.2 p -167.74 173.17 8.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.859 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -81.09 151.82 28.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.124 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -155.53 36.57 0.63 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.412 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -152.16 123.73 1.52 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.492 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.5 t -178.81 -38.33 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.86 0.362 . . . . 0.0 110.996 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 64.98 122.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.875 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 9.6 p -87.86 151.26 3.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.184 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 156.06 44.13 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.524 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 10.9 t-105 62.66 85.32 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.818 0.342 . . . . 0.0 110.963 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.5 t70 62.66 30.88 16.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.133 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 48.8 p 54.1 101.04 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.199 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_exo -51.64 106.6 0.14 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.543 2.162 . . . . 0.0 112.315 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -78.16 -26.85 6.01 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.586 2.19 . . . . 0.0 112.401 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -142.99 144.06 32.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.177 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.462 ' CB ' ' HD3' ' A' ' 102' ' ' PRO . 0.5 OUTLIER 174.97 -54.53 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.028 179.853 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.462 ' HD3' ' CB ' ' A' ' 101' ' ' SER . 51.7 Cg_exo -52.09 147.96 25.5 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.826 2.351 . . . . 0.0 112.248 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.505 HD12 ' HB2' ' A' ' 104' ' ' GLN . 3.5 pp -178.17 -39.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.901 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.505 ' HB2' HD12 ' A' ' 103' ' ' LEU . 1.9 tt0 -111.53 109.01 18.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.879 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -158.39 87.27 0.89 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.88 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -82.81 131.87 53.13 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.907 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -73.56 146.14 38.63 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.506 2.137 . . . . 0.0 112.268 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.03 31.19 0.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.808 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.32 154.93 82.07 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.88 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -69.86 143.77 51.38 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.663 2.242 . . . . 0.0 112.309 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 96.5 144.95 18.18 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.418 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.13 174.24 0.18 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.527 2.151 . . . . 0.0 112.276 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -100.26 108.6 53.32 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.859 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -49.4 118.72 3.87 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.463 2.108 . . . . 0.0 112.417 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.77 83.82 1.35 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.808 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -74.2 139.66 44.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.917 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.455 HD22 ' HD3' ' A' ' 43' ' ' PRO . 3.5 tt 60.64 157.88 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.936 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 98.6 p -155.17 -45.81 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.979 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -104.06 148.13 26.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.887 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.488 ' HB3' ' NE2' ' A' ' 122' ' ' HIS . . . -73.06 163.66 27.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.224 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.431 ' HB2' HG23 ' A' ' 41' ' ' VAL . 2.0 mtpp -110.41 74.53 0.88 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.049 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.489 ' CE1' HG21 ' A' ' 40' ' ' THR . 19.6 m-70 -73.05 102.7 3.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.975 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.763 HG13 ' HB2' ' A' ' 148' ' ' ALA . 24.7 t -99.94 115.65 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.965 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 72.1 p -59.74 137.44 58.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.848 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.69 HD23 ' CA ' ' A' ' 38' ' ' ALA . 4.0 mm? -98.64 53.96 1.03 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.807 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 27.1 mttt -164.45 37.3 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.006 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.713 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -178.51 -39.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.38 . . . . 0.0 110.949 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.15 -169.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.149 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.675 ' HA ' HG21 ' A' ' 176' ' ' ILE . 13.6 t80 -170.11 123.48 0.71 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.495 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.569 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.5 p -94.66 157.65 3.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.492 0.663 . . . . 0.0 111.615 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.479 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -170.31 127.67 0.83 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.696 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 18.3 ptt-85 -83.26 96.49 8.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.947 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 30.3 mtt180 -94.48 -176.91 4.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.034 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.21 -175.33 3.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.775 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.584 HG23 ' CE1' ' A' ' 143' ' ' TYR . 0.1 OUTLIER -157.62 -55.1 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.234 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 136' ' ' PRO . . . . . 0.545 ' HD3' HG23 ' A' ' 135' ' ' THR . 1.0 OUTLIER -83.49 8.3 4.7 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.766 2.311 . . . . 0.0 112.508 -179.888 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 137' ' ' THR . . . . . 0.423 HG23 ' C ' ' A' ' 136' ' ' PRO . 1.5 p 67.91 29.73 6.45 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.082 0.467 . . . . 0.0 110.456 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -109.36 92.75 12.09 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.883 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.59 78.36 1.66 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.443 2.095 . . . . 0.0 112.488 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.489 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.2 OUTLIER -152.86 -68.1 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.984 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.489 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 66.8 Cg_endo -73.2 -43.67 0.68 Allowed 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.193 1.929 . . . . 0.0 112.062 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? 62.74 124.51 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.008 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.584 ' CE1' HG23 ' A' ' 135' ' ' THR . 7.7 m-85 -80.96 114.86 20.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.777 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.544 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 2.0 mt -69.94 94.02 0.82 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.97 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -99.9 123.67 44.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.78 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.484 HD11 HD13 ' A' ' 172' ' ' ILE . 22.5 mt -128.81 120.8 53.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.212 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -101.91 129.74 48.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.775 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.763 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -110.98 146.46 36.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.192 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.713 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.1 30.84 2.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.283 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -114.95 44.92 1.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.062 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.93 20.93 3.3 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.692 -0.686 . . . . 0.0 112.249 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 58.69 61.33 2.23 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.066 0.46 . . . . 0.0 110.949 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.604 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.4 m-20 -92.85 157.96 16.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.682 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -161.15 92.78 0.93 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.225 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.8 m -84.49 127.17 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.032 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -109.21 88.72 2.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.742 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.492 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.5 mt -95.95 153.57 17.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.901 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.457 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER -127.83 94.02 3.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.841 -179.893 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.992 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -58.24 143.53 44.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.123 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.07 -32.95 51.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.816 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.12 168.6 10.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.848 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -88.72 -61.3 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.878 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -59.7 -31.96 70.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.075 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -49.82 70.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.745 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.992 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -60.44 -41.87 94.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.183 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -71.33 -40.38 70.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.545 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 94.4 p -68.59 -33.89 74.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.097 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.732 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -74.28 -49.1 24.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.839 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.544 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -58.57 -49.76 76.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.328 0.585 . . . . 0.0 110.278 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.65 -42.02 96.0 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.425 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.18 -40.68 77.96 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.77 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.718 HG22 HD12 ' A' ' 176' ' ' ILE . 11.2 mt -60.33 -24.43 30.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.569 ' N ' HG11 ' A' ' 130' ' ' VAL . 6.3 tp60 -81.43 -29.88 33.7 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.008 -0.997 . . . . 0.0 110.069 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.79 -49.8 71.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.119 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.24 -42.14 84.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.713 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.718 HD12 HG22 ' A' ' 172' ' ' ILE . 80.5 mt -76.83 -5.55 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.42 179.519 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -87.13 26.12 7.17 Favored Glycine 0 C--N 1.332 0.359 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.454 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.144 -0.931 . . . . 0.0 110.963 -179.928 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.758 0.313 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.7 m -74.48 138.77 43.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.946 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -177.04 84.59 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.501 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 13.6 ttp85 -97.3 23.18 7.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.679 0.276 . . . . 0.0 111.096 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.89 92.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.927 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -136.24 131.17 18.55 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.041 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.91 129.63 11.7 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.512 2.141 . . . . 0.0 112.366 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.4 ttt85 -72.37 141.95 48.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.833 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 77.4 p -143.34 165.13 28.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.978 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 173.8 135.52 2.03 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.421 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.8 mt -68.62 122.36 18.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 0.0 110.935 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.494 HD22 ' HB3' ' A' ' 157' ' ' LEU . 0.1 OUTLIER -131.91 158.41 41.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.723 179.797 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.81 150.95 20.82 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.071 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.418 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 7.3 tp -134.29 137.54 44.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.577 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.532 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.7 -164.32 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.82 -179.717 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -159.78 129.67 5.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.759 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.536 ' O ' ' HB3' ' A' ' 18' ' ' ALA . . . 159.66 -25.39 0.32 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.565 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.536 ' HB3' ' O ' ' A' ' 17' ' ' GLY . . . 75.56 -68.45 0.2 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.895 0.379 . . . . 0.0 111.292 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.11 -140.34 3.21 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.592 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.6 m -57.66 137.45 56.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.323 . . . . 0.0 111.033 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 122.12 39.47 0.55 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.495 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.9 77.32 0.08 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.835 0.35 . . . . 0.0 111.168 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -123.99 43.38 1.42 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.464 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 171.09 -65.43 0.15 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.518 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 62.78 137.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.86 0.362 . . . . 0.0 110.871 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -149.33 73.96 1.22 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.023 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.532 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 24.7 m95 -54.42 108.77 0.41 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.902 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.16 152.54 24.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.065 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.97 135.01 37.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.982 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.644 HG12 ' HA ' ' A' ' 43' ' ' PRO . 33.0 m -148.25 125.75 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.26 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.8 tp -69.8 135.94 50.26 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.596 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.61 HD12 HG13 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -104.53 142.0 35.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.747 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.0 m -123.12 94.53 4.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.884 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.507 HD11 HG13 ' A' ' 172' ' ' ILE . 0.4 OUTLIER -85.55 96.81 9.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.815 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -107.63 137.8 45.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.951 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -57.1 -23.0 43.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.081 0.467 . . . . 0.0 111.226 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 89.9 m-20 -85.11 -31.1 23.52 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.722 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -175.79 168.76 3.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.021 0.439 . . . . 0.0 111.315 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.535 ' C ' HD13 ' A' ' 39' ' ' LEU . 3.2 tm? -111.0 108.77 18.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.417 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.3 m -114.2 139.23 49.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.254 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.61 HG13 HD12 ' A' ' 32' ' ' LEU . 16.8 t -117.46 159.69 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.881 179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.472 ' N ' HG12 ' A' ' 41' ' ' VAL . 3.1 t -156.34 152.55 23.36 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.708 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.644 ' HA ' HG12 ' A' ' 30' ' ' VAL . 60.0 Cg_endo -72.08 47.71 1.06 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.485 2.123 . . . . 0.0 112.485 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 50.75 29.25 4.12 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.118 0.485 . . . . 0.0 111.11 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -138.8 74.17 1.46 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.705 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -116.19 107.39 1.65 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.496 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -142.29 156.37 64.25 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 120.66 0.267 . . . . 0.0 110.939 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.56 163.85 33.31 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.507 2.138 . . . . 0.0 112.255 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.66 79.73 1.45 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.455 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.39 154.94 70.86 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.611 2.207 . . . . 0.0 112.277 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -148.96 100.41 3.44 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.852 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -49.24 132.86 29.31 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.507 2.138 . . . . 0.0 112.421 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -68.54 127.07 93.27 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.847 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.51 176.87 8.71 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.442 2.095 . . . . 0.0 112.302 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -84.12 158.34 21.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.121 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 60.85 165.49 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.36 -33.0 70.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.959 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -123.98 155.41 38.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.925 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.69 -81.07 1.12 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.517 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -102.73 103.15 13.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.835 0.35 . . . . 0.0 111.097 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.627 ' HB1' ' HD2' ' A' ' 63' ' ' PRO . . . 59.54 160.92 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.13 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.556 ' N ' ' CD ' ' A' ' 63' ' ' PRO . 2.1 mp0 -76.43 -43.07 3.29 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.486 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.627 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 51.6 Cg_exo -52.35 144.76 38.64 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.587 2.191 . . . . 0.0 112.306 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -138.85 34.84 2.05 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.797 -0.715 . . . . 0.0 112.577 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.75 115.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.816 0.341 . . . . 0.0 111.085 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 60.61 87.53 0.13 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.06 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -49.08 105.04 0.09 OUTLIER 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.658 2.239 . . . . 0.0 112.46 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.08 165.96 31.33 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.424 2.083 . . . . 0.0 112.301 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -89.15 135.36 33.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 70' ' ' LEU . 4.5 mm? -102.12 105.65 43.68 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.03 -174.02 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.34 2.027 . . . . 0.0 112.315 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.628 ' HA ' HD11 ' A' ' 75' ' ' LEU . 2.4 mt-10 64.56 70.93 0.48 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.39 0.614 . . . . 0.0 110.671 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 167.47 -45.52 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.536 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -93.54 -30.3 15.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.684 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.722 HD12 ' N ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -75.81 -15.27 60.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.508 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.722 ' N ' HD12 ' A' ' 75' ' ' LEU . 3.0 tp -70.94 -43.83 67.36 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.837 0.351 . . . . 0.0 110.867 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -69.44 -74.82 0.12 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.856 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 69.66 -64.64 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.111 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -94.84 36.15 1.21 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.19 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.5 t -144.64 -68.32 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.025 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.48 167.11 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.991 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -68.64 60.02 1.14 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.913 2.409 . . . . 0.0 112.286 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -159.38 31.88 0.2 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.016 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -128.08 -176.53 3.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.858 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.6 ttpp -93.37 -34.58 13.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -125.87 174.64 8.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.871 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.1 m -110.01 -72.66 0.71 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.904 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -87.25 -72.01 0.53 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.068 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 98.62 147.34 21.97 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.451 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 109.21 -115.13 4.19 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.454 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.3 t -143.72 133.57 23.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.864 0.364 . . . . 0.0 110.858 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.8 m -90.51 135.08 33.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.94 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.56 HG22 ' O ' ' A' ' 93' ' ' VAL . 12.4 p -91.32 49.62 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.087 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -116.14 27.78 7.97 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.546 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 7.6 m95 -114.37 31.21 6.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.921 0.391 . . . . 0.0 110.881 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -157.87 45.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.955 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.0 m -143.22 154.96 61.69 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.84 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -68.44 148.93 74.34 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.422 2.081 . . . . 0.0 112.363 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -77.7 59.14 6.7 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.489 2.126 . . . . 0.0 112.328 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -149.82 155.65 40.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.141 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -137.51 171.79 7.91 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.86 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_exo -51.11 171.92 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.541 2.161 . . . . 0.0 112.336 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.13 145.45 24.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.888 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -99.26 141.27 32.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.859 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -174.54 134.14 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.853 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.42 ' CB ' ' HD3' ' A' ' 107' ' ' PRO . 0.0 OUTLIER -87.75 -51.23 0.41 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.947 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.42 ' HD3' ' CB ' ' A' ' 106' ' ' GLN . 3.1 Cg_exo -74.83 108.97 2.83 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.716 2.277 . . . . 0.0 112.073 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 13.5 m -163.55 171.83 15.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.087 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -135.23 150.12 71.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.88 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.96 179.17 4.0 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.516 2.144 . . . . 0.0 112.417 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 174.37 -75.84 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.442 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.71 -166.23 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.604 2.203 . . . . 0.0 112.305 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.93 117.47 61.47 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.85 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.95 -172.89 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.447 2.098 . . . . 0.0 112.341 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.0 146.83 29.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.948 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 60.17 177.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.87 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 15.8 tp -96.91 102.94 14.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.909 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.7 p -103.36 -31.67 9.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.897 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -104.75 176.7 5.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.902 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.17 169.83 16.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.082 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.473 ' HE2' HG13 ' A' ' 155' ' ' VAL . 0.9 OUTLIER -129.3 91.18 3.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.91 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -80.22 143.18 33.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.928 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.409 ' CG1' ' HB2' ' A' ' 148' ' ' ALA . 20.3 t -142.22 140.48 29.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.122 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.706 ' C ' HD22 ' A' ' 125' ' ' LEU . 1.4 m -76.74 158.52 30.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.722 HD23 ' HA ' ' A' ' 38' ' ' ALA . 3.7 mm? -123.18 43.66 2.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.939 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -142.82 35.73 1.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.846 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.779 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER 179.25 -36.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.954 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.85 -173.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.316 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.576 ' HA ' HG21 ' A' ' 176' ' ' ILE . 17.8 t80 -170.04 128.2 0.89 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.682 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.626 HG12 HD12 ' A' ' 176' ' ' ILE . 2.4 p -105.52 159.52 5.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.321 0.581 . . . . 0.0 111.493 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -165.46 134.22 3.27 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.78 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.4 ' NH1' ' NH2' ' A' ' 142' ' ' ARG . 2.4 ptt180 -99.59 91.88 5.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.098 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.85 -170.24 1.55 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.619 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 28.8 p -143.67 122.65 12.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.969 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 2.0 p -93.25 159.24 35.75 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.791 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.69 -6.05 18.31 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.587 2.191 . . . . 0.0 112.791 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 25.6 p -123.65 30.31 6.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.821 0.344 . . . . 0.0 110.933 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -135.97 79.58 44.56 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.923 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.72 -71.4 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.522 2.148 . . . . 0.0 112.357 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.412 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.4 OUTLIER -72.42 -61.51 1.74 Allowed Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.097 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.412 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 46.0 Cg_endo -68.6 170.1 15.87 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.393 2.062 . . . . 0.0 112.381 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.4 ' NH2' ' NH1' ' A' ' 132' ' ' ARG . 2.8 mtt180 -134.23 -178.5 5.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.903 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.433 ' CZ ' ' HB3' ' A' ' 156' ' ' PHE . 5.1 t80 -103.26 114.08 28.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.991 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.664 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.7 OUTLIER -95.6 114.63 26.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.852 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.412 ' HG3' ' CE1' ' A' ' 156' ' ' PHE . 43.3 tt0 -120.78 128.71 53.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.994 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 1.122 HD13 HG21 ' A' ' 172' ' ' ILE . 19.6 mt -132.3 110.03 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.168 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.27 122.54 40.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.806 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.605 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -105.45 146.57 29.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.24 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.779 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.31 30.47 2.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.261 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -115.06 44.95 1.7 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.076 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.54 23.45 2.58 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.17 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 56.64 59.23 3.66 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.048 0.451 . . . . 0.0 110.978 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.605 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 6.6 m-20 -90.58 160.36 15.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.797 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -165.98 95.45 0.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.159 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.473 HG13 ' HE2' ' A' ' 121' ' ' LYS . 11.1 m -90.1 128.46 42.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.167 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.433 ' HB3' ' CZ ' ' A' ' 143' ' ' TYR . 20.9 m-85 -115.93 92.42 3.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.67 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.494 ' HB3' HD22 ' A' ' 12' ' ' LEU . 1.5 mt -98.61 168.18 10.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.128 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.467 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER -134.14 93.47 3.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.571 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 1.071 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.28 168.96 0.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.339 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -84.37 -67.27 0.81 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.959 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -90.28 164.57 14.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.943 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.99 -43.24 79.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.837 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -67.74 -32.54 73.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.077 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 62.2 m -66.28 -50.07 64.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.797 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 1.071 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -62.22 -37.51 85.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.911 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 15.0 ttt180 -72.74 -43.86 62.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.387 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.3 t -65.59 -32.9 74.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.945 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.425 ' CZ3' ' HB2' ' A' ' 34' ' ' LEU . 8.5 m95 -74.16 -53.15 10.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.691 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.664 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -58.08 -50.78 72.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.339 0.59 . . . . 0.0 110.388 179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.74 -38.38 91.84 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.554 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -71.29 -40.21 71.01 Favored 'General case' 0 CA--C 1.511 -0.545 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.999 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 1.122 HG21 HD13 ' A' ' 146' ' ' ILE . 8.4 mt -62.54 -22.7 30.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.572 ' N ' HG11 ' A' ' 130' ' ' VAL . 26.5 tt0 -77.35 -40.47 43.9 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.434 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 174' ' ' ALA . . . . . 0.407 ' HA ' ' CG2' ' A' ' 178' ' ' THR . . . -63.36 -37.53 87.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.471 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 175' ' ' GLN . . . . . 0.426 ' C ' HD12 ' A' ' 125' ' ' LEU . 4.7 mp0 -76.81 -33.08 58.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.187 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.626 HD12 HG12 ' A' ' 130' ' ' VAL . 48.1 mt -73.75 -28.92 25.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.809 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.468 ' O ' HG22 ' A' ' 178' ' ' THR . . . 151.12 -41.96 0.75 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.781 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 178' ' ' THR . . . . . 0.468 HG22 ' O ' ' A' ' 177' ' ' GLY . 14.5 t . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.254 -0.879 . . . . 0.0 111.517 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.821 0.343 . . . . 0.0 111.076 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.1 -57.52 1.77 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.878 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -103.82 -137.75 9.47 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.491 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.93 -28.56 8.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.756 0.312 . . . . 0.0 110.958 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 60.93 97.22 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.848 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -136.43 102.28 9.75 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.097 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -67.85 135.52 35.61 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.444 2.096 . . . . 0.0 112.234 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.89 152.34 18.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.761 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.665 HG22 ' HA ' ' A' ' 33' ' ' SER . 6.9 p -146.13 158.07 43.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.997 0.427 . . . . 0.0 111.219 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -156.11 135.28 4.46 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.266 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 11' ' ' LEU . 12.9 mt -62.92 106.69 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.778 0.323 . . . . 0.0 110.911 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -117.03 170.07 8.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.865 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.613 ' O ' HD23 ' A' ' 157' ' ' LEU . 9.0 mt-10 -107.68 162.68 13.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.016 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.6 tp -137.1 129.66 30.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.553 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.482 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 37.9 ttp180 -69.54 165.07 21.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.874 0.369 . . . . 0.0 110.717 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.8 t -145.92 81.15 1.59 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.944 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -99.82 -72.84 1.03 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.493 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -84.86 73.96 10.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.874 0.369 . . . . 0.0 111.123 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -98.51 -65.87 0.87 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.504 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.3 t -111.08 -33.76 6.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.83 0.347 . . . . 0.0 110.828 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 166.41 -30.99 0.2 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.521 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -167.18 137.94 3.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.939 0.399 . . . . 0.0 111.073 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -153.82 -62.74 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.529 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 116.88 46.91 0.5 Allowed Glycine 0 N--CA 1.453 -0.202 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.535 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 61.25 84.6 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.697 0.284 . . . . 0.0 110.896 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.0 mmt85 -109.44 69.01 0.69 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.859 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.482 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 29.0 m95 -51.12 168.48 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.17 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -148.95 -166.72 2.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.882 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.0 ttp-105 -124.93 110.76 14.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.989 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.73 HG12 ' HA ' ' A' ' 43' ' ' PRO . 34.6 m -125.35 127.53 72.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.159 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.8 tp -76.04 115.53 15.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.409 HD13 HD22 ' A' ' 157' ' ' LEU . 0.4 OUTLIER -84.62 121.58 27.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.904 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.665 ' HA ' HG22 ' A' ' 9' ' ' THR . 17.7 m -103.61 86.84 2.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.647 HD13 HD13 ' A' ' 172' ' ' ILE . 14.7 tp -78.36 113.35 16.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.819 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -106.39 148.93 27.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.915 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -64.88 -11.71 40.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.712 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -134.84 16.6 3.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.314 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.633 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . 179.28 160.04 0.7 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.85 0.357 . . . . 0.0 111.265 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.65 ' HB2' HD21 ' A' ' 125' ' ' LEU . 66.5 tp -124.23 88.71 2.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.557 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.701 HG23 ' O ' ' A' ' 121' ' ' LYS . 79.4 m -94.29 145.31 24.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.158 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.497 HG12 ' N ' ' A' ' 42' ' ' SER . 21.2 t -125.65 160.21 32.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.019 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.497 ' N ' HG12 ' A' ' 41' ' ' VAL . 84.5 p -151.9 152.13 29.4 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.539 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.73 ' HA ' HG12 ' A' ' 30' ' ' VAL . 95.7 Cg_endo -78.93 37.68 0.68 Allowed 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.666 2.244 . . . . 0.0 112.852 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 46.6 29.19 0.89 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.076 0.465 . . . . 0.0 111.325 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.56 119.03 17.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.877 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -83.98 133.36 11.79 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.57 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -89.26 154.03 48.94 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.759 0.314 . . . . 0.0 110.94 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.2 163.25 38.54 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.523 2.148 . . . . 0.0 112.35 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -144.68 -149.61 5.07 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.505 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -51.84 104.64 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.604 2.203 . . . . 0.0 112.353 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 60.94 87.6 0.13 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.84 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.56 176.36 6.72 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.627 2.218 . . . . 0.0 112.253 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -141.7 70.02 25.16 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.85 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.82 -168.07 0.34 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.538 2.159 . . . . 0.0 112.357 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 62.44 118.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.066 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -105.57 162.61 13.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.917 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 57' ' ' LEU . 4.1 mm? -109.09 36.67 2.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.838 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -86.32 129.72 34.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.867 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -175.37 -105.31 0.19 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.514 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.4 179.53 5.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.811 0.338 . . . . 0.0 111.069 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -136.05 175.25 9.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.093 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -89.02 111.89 47.64 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.986 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -55.63 160.98 8.44 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.473 2.115 . . . . 0.0 112.274 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 107.53 -43.5 1.68 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.543 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.49 138.42 58.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.827 0.346 . . . . 0.0 111.104 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.681 ' HB1' ' HD2' ' A' ' 67' ' ' PRO . . . -61.61 165.02 8.07 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.044 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.681 ' HD2' ' HB1' ' A' ' 66' ' ' ALA . 57.3 Cg_endo -71.0 110.84 2.91 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.571 2.181 . . . . 0.0 112.323 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.66 -168.25 0.55 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.427 2.085 . . . . 0.0 112.316 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.7 129.13 36.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.82 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.2 mt -61.96 123.35 77.3 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.853 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.751 ' HA ' HD22 ' A' ' 75' ' ' LEU . 51.4 Cg_endo -69.09 178.24 4.35 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.452 2.102 . . . . 0.0 112.548 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.423 ' N ' HD13 ' A' ' 75' ' ' LEU . 3.1 pt-20 -157.68 53.06 0.47 Allowed 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.158 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 59.36 28.07 17.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.276 0.56 . . . . 0.0 110.15 -179.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.489 ' C ' HD23 ' A' ' 74' ' ' LEU . 10.3 tt -150.51 -48.6 0.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.979 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.751 HD22 ' HA ' ' A' ' 71' ' ' PRO . 7.1 mp -61.43 -38.04 85.69 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.786 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.1 tp -53.78 -46.57 71.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.119 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 14.4 mp0 -93.85 45.85 1.16 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.901 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.611 ' O ' HG23 ' A' ' 80' ' ' VAL . 38.8 ttt180 -110.3 129.69 55.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.914 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.2 31.51 20.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.985 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 78' ' ' ARG . 24.9 t -130.95 -57.54 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.061 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.423 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.1 OUTLIER -79.08 -54.2 1.04 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.736 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 81' ' ' SER . 88.7 Cg_endo -86.3 39.93 0.69 Allowed 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 123.194 2.596 . . . . 0.0 112.655 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER 179.41 134.18 0.09 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 59.7 43.06 16.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.85 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -118.08 -50.79 2.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.925 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -98.25 106.12 18.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.775 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 28.6 t -134.07 -68.81 0.55 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.849 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 59.49 -178.12 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.13 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 110.28 -66.4 0.24 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.526 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -129.61 106.74 0.75 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.513 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.472 ' O ' HG23 ' A' ' 91' ' ' THR . 11.2 t -99.88 116.25 31.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.824 0.345 . . . . 0.0 110.916 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.2 p -103.66 131.96 50.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.87 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.9 p -79.28 130.56 35.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.059 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -135.88 59.38 0.65 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.509 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER 62.34 99.53 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.853 0.358 . . . . 0.0 110.798 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -133.61 53.25 2.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.846 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.67 108.57 43.55 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.921 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.425 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 26.2 Cg_exo -62.85 120.51 8.04 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.544 2.163 . . . . 0.0 112.135 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 98' ' ' PRO . 26.9 Cg_exo -62.16 -26.05 77.57 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.457 2.105 . . . . 0.0 111.994 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -126.91 -173.99 3.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.087 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 73.0 m -97.67 112.44 61.43 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.804 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -51.53 -178.16 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.416 2.077 . . . . 0.0 112.34 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.2 mt 62.03 95.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.868 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.52 -168.83 2.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.881 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.23 43.21 1.11 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.967 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -151.1 70.41 8.46 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.875 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.85 164.76 34.68 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.566 2.177 . . . . 0.0 112.333 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.75 -176.43 0.11 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.014 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.56 166.19 7.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.957 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.19 157.54 56.98 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.644 2.23 . . . . 0.0 112.393 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.422 ' N ' ' HD3' ' A' ' 112' ' ' PRO . . . 57.95 62.55 6.18 Favored Glycine 0 CA--C 1.52 0.368 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.611 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.422 ' HD3' ' N ' ' A' ' 111' ' ' GLY . 20.4 Cg_exo -65.67 102.1 0.49 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.672 2.248 . . . . 0.0 112.327 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.553 ' HB2' ' HD3' ' A' ' 114' ' ' PRO . 2.2 mt-30 -135.73 -66.35 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.571 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' PRO . . . . . 0.553 ' HD3' ' HB2' ' A' ' 113' ' ' GLN . 86.9 Cg_exo -43.45 94.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.687 2.258 . . . . 0.0 112.51 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -114.53 92.48 3.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.107 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -91.57 116.34 28.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.7 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 61.67 82.46 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.691 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 5.7 t -63.75 -35.91 82.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.003 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.87 162.3 23.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.895 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.414 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -80.02 157.57 26.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.047 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.701 ' O ' HG23 ' A' ' 40' ' ' THR . 0.8 OUTLIER -88.44 160.31 17.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.914 179.923 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.405 ' CE1' ' O ' ' A' ' 120' ' ' ALA . 16.9 m80 -152.27 113.01 4.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.77 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.449 HG11 ' HB2' ' A' ' 148' ' ' ALA . 21.5 t -119.94 133.63 66.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.144 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 13.1 t -75.46 147.11 40.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.812 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.912 HD13 ' HB3' ' A' ' 175' ' ' GLN . 18.1 mt -104.2 38.08 1.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.043 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -128.59 34.29 4.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.792 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.798 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER 179.58 -35.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.009 179.989 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.56 -173.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.347 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -170.07 111.29 0.43 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.491 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.618 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -87.45 159.18 3.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.272 0.558 . . . . 0.0 111.406 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.466 ' N ' HG22 ' A' ' 130' ' ' VAL . 97.8 p -162.05 149.14 13.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.708 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.443 ' HD3' ' HB3' ' A' ' 169' ' ' ALA . 27.9 ptt85 -118.69 95.79 4.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.965 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -85.37 -167.58 1.89 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.847 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 6.2 p -124.61 156.22 37.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.913 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 60.4 p -121.37 145.98 43.74 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.804 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.7 -30.46 7.69 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.641 2.227 . . . . 0.0 112.337 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 26.1 p -73.6 -33.59 64.67 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.972 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.4 ' O ' ' HD2' ' A' ' 141' ' ' PRO . 0.2 OUTLIER -146.27 92.78 5.17 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.022 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -82.32 63.35 8.17 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.559 2.172 . . . . 0.0 112.281 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.747 ' HB2' ' HD3' ' A' ' 141' ' ' PRO . 54.4 mt-10 -157.51 -54.71 0.02 OUTLIER Pre-proline 0 CA--C 1.532 0.258 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.607 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.747 ' HD3' ' HB2' ' A' ' 140' ' ' GLU . 23.7 Cg_exo -64.41 -21.84 66.22 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.163 1.908 . . . . 0.0 112.129 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 61.97 151.9 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.962 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -94.0 115.21 27.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.9 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.776 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.9 OUTLIER -89.68 98.24 11.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.77 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -108.39 137.31 46.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.895 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.503 HD13 HG21 ' A' ' 172' ' ' ILE . 23.3 mt -137.27 108.81 6.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.144 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.3 m -92.51 135.37 34.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.864 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -113.12 144.9 41.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.187 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.798 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -94.55 30.9 1.88 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.304 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -121.44 48.17 1.72 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.129 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.28 18.77 3.68 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.375 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' GLN . . . . . 0.417 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 4.8 mm-40 58.64 61.67 2.15 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.096 0.474 . . . . 0.0 111.021 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.864 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 1.2 m-20 -89.85 163.81 14.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.8 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.85 96.47 0.44 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.068 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.3 m -97.63 121.76 48.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.169 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 156' ' ' PHE . 0.5 OUTLIER -113.05 106.29 14.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.791 179.802 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.613 HD23 ' O ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -111.92 166.23 11.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.067 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.427 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -129.15 109.96 11.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.868 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.91 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -68.83 158.76 33.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.076 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -31.5 24.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.95 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -109.32 160.54 16.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.944 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -74.16 -61.78 1.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -58.99 -27.89 65.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.172 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 45.2 t -66.64 -48.43 69.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.699 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.91 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -62.12 -42.51 99.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.973 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 40.7 mtt180 -71.27 -40.81 70.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.449 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 32.6 t -67.66 -34.38 76.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.059 0.457 . . . . 0.0 109.939 179.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.445 ' O ' HG12 ' A' ' 172' ' ' ILE . 12.9 m95 -72.5 -52.49 15.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.67 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.776 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -56.53 -45.98 80.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.171 0.51 . . . . 0.0 110.465 179.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.61 -43.98 95.85 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.518 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.36 -40.8 77.26 Favored 'General case' 0 CA--C 1.511 -0.544 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.611 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.768 HG22 HD12 ' A' ' 176' ' ' ILE . 12.9 mm -58.67 -24.81 26.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.618 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -84.12 -28.62 27.36 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.2 179.216 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.42 -40.87 77.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.247 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' GLN . . . . . 0.912 ' HB3' HD13 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -75.14 -41.27 58.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.004 179.156 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.768 HD12 HG22 ' A' ' 172' ' ' ILE . 54.0 mt -79.9 -10.29 12.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.268 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -85.55 25.38 6.5 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.367 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 178' ' ' THR . . . . . 0.418 HG22 ' O ' ' A' ' 175' ' ' GLN . 9.8 t . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.96 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.83 0.348 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.5 92.4 7.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.888 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -93.87 -154.49 31.09 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.551 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -108.05 31.56 5.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.772 0.32 . . . . 0.0 110.816 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.47 153.21 32.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.964 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -133.16 98.39 15.65 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.071 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.82 152.05 18.34 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.55 2.166 . . . . 0.0 112.271 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.74 100.31 6.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.869 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.468 HG22 ' HA ' ' A' ' 33' ' ' SER . 20.7 p -100.65 167.8 10.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.986 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.81 132.05 2.2 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.371 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -59.91 123.46 17.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.864 0.364 . . . . 0.0 110.87 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.607 HD21 ' CD1' ' A' ' 144' ' ' LEU . 0.1 OUTLIER -136.17 170.13 16.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.801 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.571 ' O ' HD23 ' A' ' 157' ' ' LEU . 8.1 mt-10 -104.29 152.45 22.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.061 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.519 ' HB2' HG21 ' A' ' 30' ' ' VAL . 26.6 tp -138.71 137.15 36.52 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.564 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.479 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 7.1 ptt180 -69.69 -165.34 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.763 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.0 t -171.42 135.31 0.92 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.977 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 168.0 49.56 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.488 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -107.45 178.39 4.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.899 0.38 . . . . 0.0 111.033 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.8 -78.74 0.61 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.547 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.6 p -162.28 157.64 23.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.849 0.357 . . . . 0.0 110.893 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 127.65 161.74 10.88 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.414 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -149.06 127.78 12.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.852 0.358 . . . . 0.0 111.058 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.92 39.66 85.08 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.628 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -141.89 56.62 0.58 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.401 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.99 125.2 25.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.877 0.37 . . . . 0.0 110.909 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.407 ' NH2' HD22 ' A' ' 75' ' ' LEU . 0.8 OUTLIER -116.27 74.27 0.89 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.775 -179.981 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.479 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 18.9 m95 -57.46 101.91 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.026 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -96.06 165.63 12.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.887 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.7 ttp180 -84.68 147.13 27.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.008 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.519 HG21 ' HB2' ' A' ' 14' ' ' LEU . 35.5 m -155.1 144.2 12.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.983 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.9 tp -100.48 124.68 46.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.573 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.542 HD22 HD13 ' A' ' 12' ' ' LEU . 3.5 mp -89.52 151.27 22.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.915 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.468 ' HA ' HG22 ' A' ' 9' ' ' THR . 10.3 t -131.39 98.42 4.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.596 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.735 ' HA ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -86.89 95.73 9.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.025 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -99.37 142.69 30.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.931 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -59.97 -17.62 39.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.352 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -93.48 -27.87 16.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.974 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.486 ' HB1' ' O ' ' A' ' 123' ' ' VAL . . . -179.94 -170.84 0.16 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.207 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 34' ' ' LEU . 8.2 tp -115.47 154.79 28.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.823 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.615 HG23 ' CD2' ' A' ' 122' ' ' HIS . 91.3 m -155.15 140.9 18.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.07 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.422 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 3.9 t -127.61 156.18 39.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.14 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -153.52 167.43 13.59 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.495 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -79.19 45.54 1.96 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.534 2.156 . . . . 0.0 112.749 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 47.13 29.51 1.15 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.01 0.433 . . . . 0.0 111.159 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.2 p30 -85.72 -176.85 6.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.88 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 167.62 -165.51 38.72 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.597 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -140.0 156.04 70.6 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 120.664 0.268 . . . . 0.0 110.874 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -68.22 151.69 76.58 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.489 2.126 . . . . 0.0 112.256 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -86.63 -80.05 1.19 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.603 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.502 ' HB2' ' HD2' ' A' ' 52' ' ' PRO . 93.0 Cg_endo -77.35 -164.28 0.26 Allowed 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.586 2.191 . . . . 0.0 112.2 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.44 ' HB2' ' HD3' ' A' ' 52' ' ' PRO . 1.0 OUTLIER -72.54 -48.86 9.03 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.571 -179.48 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.502 ' HD2' ' HB2' ' A' ' 50' ' ' PRO . 37.1 Cg_exo -60.9 101.49 0.18 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.422 2.082 . . . . 0.0 112.152 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -85.09 140.71 37.04 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.862 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.74 62.53 6.47 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.675 2.25 . . . . 0.0 112.348 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -149.93 157.45 43.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.161 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.39 -21.85 25.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.045 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 70.33 -65.85 0.3 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.782 0.325 . . . . 0.0 110.834 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -133.97 134.12 42.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.892 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -151.55 -86.56 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.509 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.93 174.64 15.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.743 0.306 . . . . 0.0 111.182 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -163.08 106.95 1.05 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.077 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.44 ' N ' ' HD2' ' A' ' 63' ' ' PRO . 0.6 OUTLIER -64.37 -58.95 12.02 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.019 179.924 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.44 ' HD2' ' N ' ' A' ' 62' ' ' GLU . 65.7 Cg_endo -75.42 169.36 22.59 Favored 'Trans proline' 0 N--CA 1.463 -0.279 0 C-N-CA 122.971 2.447 . . . . 0.0 112.297 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -139.28 -44.51 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.622 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -137.71 125.98 23.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.92 0.39 . . . . 0.0 111.135 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.22 154.85 42.66 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.104 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -69.07 110.37 2.4 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.585 2.19 . . . . 0.0 112.325 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -62.97 103.4 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.537 2.158 . . . . 0.0 112.268 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -146.3 21.57 1.36 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.099 0.475 . . . . 0.0 111.287 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.0 mp 62.14 145.78 0.08 OUTLIER Pre-proline 0 C--N 1.32 -0.714 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.903 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -56.22 -167.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.5 2.133 . . . . 0.0 112.185 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.642 ' HA ' HD11 ' A' ' 75' ' ' LEU . 2.4 mt-10 64.76 71.35 0.46 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.44 0.638 . . . . 0.0 110.81 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 168.61 -35.44 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.621 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 7.4 tt -110.08 -34.9 6.27 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.798 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.681 HD12 ' N ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -69.3 -15.06 63.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.451 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.681 ' N ' HD12 ' A' ' 75' ' ' LEU . 0.1 OUTLIER -88.47 -29.59 20.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.896 0.379 . . . . 0.0 111.008 -179.981 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -59.23 -26.3 64.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.083 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -94.28 42.39 1.09 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.871 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -150.48 30.67 0.67 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.857 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 23.7 t -124.28 -40.38 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.06 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.499 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.8 OUTLIER -54.69 -48.93 94.05 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.915 0.388 . . . . 0.0 111.279 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.499 ' CD ' ' N ' ' A' ' 81' ' ' SER . 2.9 Cg_exo -74.3 52.39 2.75 Favored 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 123.293 2.662 . . . . 0.0 112.34 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.415 ' CG ' ' O ' ' A' ' 82' ' ' PRO . 0.4 OUTLIER 174.61 38.67 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.899 0.381 . . . . 0.0 110.698 180.0 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.1 t80 179.64 127.27 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.734 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.4 mttt 60.77 172.74 0.1 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.898 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.5 p-10 -94.26 103.7 15.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.895 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.3 m -73.41 -168.41 0.53 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.887 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -144.82 92.87 2.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.036 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -171.78 143.83 7.75 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.529 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 89.63 -162.5 30.43 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.463 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.9 t -82.38 118.46 23.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.759 0.314 . . . . 0.0 110.834 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 18.3 m -138.63 111.46 7.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.928 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.1 p -91.6 150.49 3.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.048 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -178.1 -56.63 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.503 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 6.1 t-105 -125.83 38.89 4.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.816 0.341 . . . . 0.0 110.883 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 14.2 t70 60.88 31.98 20.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.925 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -83.27 155.51 66.64 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.856 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.91 111.07 2.74 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.634 2.223 . . . . 0.0 112.306 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -77.61 -27.7 5.98 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.504 2.136 . . . . 0.0 112.286 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -140.5 164.39 30.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.13 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 2.8 m -125.89 157.17 70.03 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.823 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -52.04 149.86 20.09 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.542 2.162 . . . . 0.0 112.222 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.6 mm? 60.89 109.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.861 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -82.53 147.75 28.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.928 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 22.8 mtp85 -80.88 139.02 36.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.859 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -172.71 59.08 0.24 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.834 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -69.21 -46.73 1.32 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.643 2.229 . . . . 0.0 112.311 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.8 t -92.32 167.66 11.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.917 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.1 m -90.25 138.51 27.19 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.869 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.95 162.04 32.45 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.523 2.148 . . . . 0.0 112.496 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.42 ' N ' ' HD3' ' A' ' 112' ' ' PRO . . . 57.12 62.97 5.75 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.919 -0.657 . . . . 0.0 112.707 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.42 ' HD3' ' N ' ' A' ' 111' ' ' GLY . 17.0 Cg_exo -66.93 -162.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.669 2.246 . . . . 0.0 112.259 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -138.9 101.15 7.87 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.842 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.67 122.51 9.92 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.43 2.086 . . . . 0.0 112.222 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.8 93.13 7.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.887 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -152.96 -46.54 0.1 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.88 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 7.3 tp -111.43 96.86 6.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.954 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.1 p -81.59 -31.74 32.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.878 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.83 -168.27 1.58 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.832 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.422 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -132.5 165.83 23.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.17 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.4 ' HB2' ' HB ' ' A' ' 41' ' ' VAL . 12.3 mtmm -104.48 90.48 3.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.96 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.615 ' CD2' HG23 ' A' ' 40' ' ' THR . 12.6 m-70 -93.03 116.3 28.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.935 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.636 HG13 ' HB2' ' A' ' 148' ' ' ALA . 4.5 t -90.93 115.97 31.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.893 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 21.2 m -57.05 -28.01 62.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.259 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.3 mp 63.97 -166.94 0.22 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.809 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.1 tttt 63.14 33.44 14.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.815 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.511 ' HG3' ' HB3' ' A' ' 149' ' ' ALA . 2.3 ptt? 176.76 -35.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.79 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.407 ' HB2' ' HA ' ' A' ' 148' ' ' ALA . . . -53.6 -175.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.376 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.476 ' CE2' ' CB ' ' A' ' 147' ' ' CYS . 1.0 OUTLIER -162.07 113.96 1.69 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.75 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.611 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.3 p -89.31 159.9 2.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.381 0.61 . . . . 0.0 111.414 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.488 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.4 OUTLIER -165.98 138.28 3.97 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.866 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.02 117.23 29.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.946 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.444 ' CB ' ' CZ ' ' A' ' 143' ' ' TYR . 0.0 OUTLIER -124.08 156.3 36.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.839 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 13.5 t -69.72 143.13 53.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.946 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.528 HG22 ' HD2' ' A' ' 136' ' ' PRO . 0.2 OUTLIER -105.54 142.34 24.54 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.858 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 136' ' ' PRO . . . . . 0.528 ' HD2' HG22 ' A' ' 135' ' ' THR . 45.7 Cg_exo -56.23 -26.38 60.83 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.524 2.15 . . . . 0.0 112.435 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 69.6 p -89.08 -37.27 15.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.111 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -107.35 119.49 50.64 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.075 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -69.56 -50.74 0.46 Allowed 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.361 2.041 . . . . 0.0 112.323 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.424 ' N ' ' CD ' ' A' ' 141' ' ' PRO . 2.9 mt-10 -93.49 -50.0 0.27 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.196 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 140' ' ' GLU . 34.8 Cg_exo -59.9 90.74 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.341 2.028 . . . . 0.0 112.223 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -76.16 128.65 35.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.838 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.444 ' CZ ' ' CB ' ' A' ' 133' ' ' ARG . 24.5 p90 -61.71 137.06 58.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.891 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.937 HD23 ' HB2' ' A' ' 169' ' ' ALA . 2.7 mt -92.17 105.57 17.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.441 ' HG3' ' CZ ' ' A' ' 156' ' ' PHE . 0.5 OUTLIER -100.29 115.31 29.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.938 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.978 HD13 HG21 ' A' ' 172' ' ' ILE . 28.1 mt -121.1 131.95 71.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.021 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.476 ' CB ' ' CE2' ' A' ' 129' ' ' TYR . 0.8 OUTLIER -120.47 123.41 42.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.972 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.636 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -106.22 147.34 29.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.083 0.468 . . . . 0.0 111.175 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.511 ' HB3' ' HG3' ' A' ' 127' ' ' MET . . . -95.47 30.38 2.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.303 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -112.68 43.65 1.62 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.072 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 122.39 23.84 2.29 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.106 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 56.71 59.42 3.55 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 120.943 0.401 . . . . 0.0 110.957 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.432 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 3.0 m-20 -89.03 149.59 23.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.855 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.22 89.1 1.41 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.996 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 4.7 m -87.12 122.35 38.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.315 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.441 ' CZ ' ' HG3' ' A' ' 145' ' ' GLU . 7.9 m-85 -107.16 97.99 7.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.604 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.571 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.4 mt -104.39 162.0 13.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.183 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.456 ' HD2' HG21 ' A' ' 135' ' ' THR . 0.0 OUTLIER -132.97 87.63 2.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.636 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 1.094 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -49.97 172.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.515 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.2 tttm -78.56 -67.13 0.77 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.984 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -98.07 179.27 4.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.927 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.88 -40.87 21.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.887 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.97 94.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.071 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 1.4 m -66.09 -48.04 72.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.575 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 1.094 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -64.54 -34.98 79.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.775 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.11 -45.52 56.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.305 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 53.8 p -63.63 -36.94 85.47 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.594 ' CZ3' HD12 ' A' ' 34' ' ' LEU . 10.2 m95 -69.23 -57.08 5.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.463 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.937 ' HB2' HD23 ' A' ' 144' ' ' LEU . . . -49.5 -57.81 6.35 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.321 0.581 . . . . 0.0 110.715 179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.42 -38.11 56.99 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.564 -0.743 . . . . 0.0 112.619 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.63 -40.59 76.46 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 120.675 -0.41 . . . . 0.0 111.04 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.978 HG21 HD13 ' A' ' 146' ' ' ILE . 39.0 mm -60.94 -23.88 31.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 177.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.611 ' N ' HG11 ' A' ' 130' ' ' VAL . 2.2 tt0 -78.01 -37.53 46.89 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.494 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 174' ' ' ALA . . . . . 0.414 ' HA ' ' CG2' ' A' ' 178' ' ' THR . . . -60.38 -46.83 88.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.614 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 89.2 mm-40 -72.02 -34.2 68.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.188 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.614 ' CD1' HG22 ' A' ' 172' ' ' ILE . 41.9 mt -70.63 -29.24 37.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.688 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.418 ' O ' HG22 ' A' ' 178' ' ' THR . . . 145.63 -43.2 0.93 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.761 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 178' ' ' THR . . . . . 0.418 HG22 ' O ' ' A' ' 177' ' ' GLY . 11.9 t . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.236 -0.887 . . . . 0.0 111.522 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.79 0.329 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -165.06 -60.36 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.985 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 121.94 -58.15 0.6 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.53 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -156.96 148.02 21.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.829 0.347 . . . . 0.0 110.962 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -176.05 142.71 0.52 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.885 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -118.01 116.96 35.7 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.096 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.85 154.13 67.75 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.417 2.078 . . . . 0.0 112.367 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -80.28 150.93 29.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.832 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 28.0 p -152.61 162.86 40.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.915 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 172.68 133.61 1.68 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.431 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.54 HD22 ' CD ' ' A' ' 29' ' ' ARG . 17.4 mt -63.09 120.1 10.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.783 0.325 . . . . 0.0 110.991 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.967 HD13 HD22 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -127.68 170.12 13.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.995 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.706 ' O ' HD23 ' A' ' 157' ' ' LEU . 3.0 tt0 -103.36 166.55 10.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.976 0.417 . . . . 0.0 111.122 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 26.1 tp -148.45 126.71 12.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.523 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.67 ' NH2' ' HB2' ' A' ' 18' ' ' ALA . 4.4 ptt180 -69.42 -166.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.909 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.6 t -170.89 70.63 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.83 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 158.39 133.08 1.49 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.524 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.67 ' HB2' ' NH2' ' A' ' 15' ' ' ARG . . . -150.69 128.63 11.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.807 0.337 . . . . 0.0 111.098 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -172.36 -84.85 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.413 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.45 33.12 4.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.734 0.302 . . . . 0.0 110.882 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.5 -122.28 6.04 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.513 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -78.26 139.59 38.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.722 0.296 . . . . 0.0 111.097 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 143.83 60.17 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.493 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.68 87.14 1.86 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.518 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -123.86 120.34 32.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.822 0.344 . . . . 0.0 110.837 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -108.36 68.27 0.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.839 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.482 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 31.0 m95 -58.92 164.24 3.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.967 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.86 173.62 15.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.937 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.54 ' CD ' HD22 ' A' ' 11' ' ' LEU . 0.8 OUTLIER -102.17 121.09 41.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.098 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.806 HG12 ' HA ' ' A' ' 43' ' ' PRO . 26.9 m -139.75 121.96 16.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.067 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.01 136.17 50.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.632 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.967 HD22 HD13 ' A' ' 12' ' ' LEU . 1.8 mp -102.57 159.76 15.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 t -142.11 92.06 2.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.679 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -79.39 97.38 6.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.858 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -101.01 137.49 39.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.062 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -56.82 -23.09 41.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.115 0.483 . . . . 0.0 111.229 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.523 ' OD1' ' HB1' ' A' ' 35' ' ' ALA . 6.7 p-10 -86.6 -32.28 20.71 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.778 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.63 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -178.15 175.27 1.25 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.175 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.885 ' HB2' HD13 ' A' ' 125' ' ' LEU . 0.3 OUTLIER -103.18 131.36 50.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.623 179.817 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.693 ' N ' HD13 ' A' ' 39' ' ' LEU . 70.4 m -131.1 128.41 40.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.942 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.569 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 15.9 t -114.93 159.13 14.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.136 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.469 ' N ' HG12 ' A' ' 41' ' ' VAL . 2.6 t -155.64 153.16 25.78 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.552 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.806 ' HA ' HG12 ' A' ' 30' ' ' VAL . 72.3 Cg_endo -74.33 45.13 1.15 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.548 2.165 . . . . 0.0 112.822 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 46.44 29.87 0.97 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.916 0.388 . . . . 0.0 111.345 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -58.74 128.09 35.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.895 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 174.02 -165.17 36.76 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.588 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -143.59 80.31 13.04 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.683 0.278 . . . . 0.0 110.878 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.18 142.07 45.14 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.58 2.187 . . . . 0.0 112.296 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 163.73 94.07 0.1 OUTLIER Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.427 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -51.2 -47.94 23.47 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.583 2.188 . . . . 0.0 112.394 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -126.1 148.68 64.08 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.807 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.55 124.06 14.31 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.557 2.171 . . . . 0.0 112.212 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -146.93 77.07 11.23 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.878 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.76 174.74 0.1 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.582 2.188 . . . . 0.0 112.235 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.92 135.0 51.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.071 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.28 98.37 7.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.857 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.578 HD23 ' H ' ' A' ' 57' ' ' LEU . 0.5 OUTLIER -69.79 160.52 31.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 60.52 160.14 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.907 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 127.78 -69.26 0.53 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.486 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -119.33 96.05 5.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.887 0.375 . . . . 0.0 111.06 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 60.01 172.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.062 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -86.66 127.27 61.03 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.874 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.16 165.24 33.2 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.397 2.064 . . . . 0.0 112.299 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -151.01 -108.77 0.42 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.395 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -118.36 179.2 4.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.912 0.387 . . . . 0.0 111.082 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -126.41 97.68 33.62 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.045 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -67.62 139.47 48.72 Favored 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 122.382 2.055 . . . . 0.0 112.21 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.09 60.49 5.52 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.478 2.118 . . . . 0.0 112.375 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.68 138.75 31.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.868 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.4 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 45.5 mt -92.11 132.86 31.39 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.794 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 70' ' ' LEU . 50.3 Cg_exo -55.03 -173.76 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.319 2.013 . . . . 0.0 112.224 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.681 ' HA ' HD11 ' A' ' 75' ' ' LEU . 2.4 mt-10 64.51 71.0 0.48 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.387 0.613 . . . . 0.0 110.724 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.551 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 167.22 -35.94 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.387 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.1 tt -106.75 -27.92 10.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.776 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.701 HD12 ' N ' ' A' ' 76' ' ' LEU . 0.4 OUTLIER -83.4 -13.85 53.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.366 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.701 ' N ' HD12 ' A' ' 75' ' ' LEU . 5.0 mt -95.49 27.3 3.45 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.828 0.347 . . . . 0.0 111.133 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -153.84 26.21 0.49 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.888 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.4 ptm85 -131.24 -39.53 1.17 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.091 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.414 ' HG3' ' CE1' ' A' ' 84' ' ' PHE . 22.0 pt-20 -95.43 30.83 2.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.052 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.7 t -117.43 -30.11 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.201 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.484 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -55.04 -49.13 93.96 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.29 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.484 ' CD ' ' N ' ' A' ' 81' ' ' SER . 53.8 Cg_endo -92.4 -141.11 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 123.597 2.864 . . . . 0.0 111.649 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.414 ' H ' ' HB2' ' A' ' 82' ' ' PRO . 61.0 m-85 -90.72 148.62 22.47 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.003 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.414 ' CE1' ' HG3' ' A' ' 79' ' ' GLU . 0.1 OUTLIER -95.94 86.06 4.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.805 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.17 54.36 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.863 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -176.25 117.4 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.921 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -119.56 31.57 6.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.953 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 59.84 108.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.159 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -97.42 29.02 11.59 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.404 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 93.71 46.52 3.16 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.816 -0.706 . . . . 0.0 112.498 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 3.6 t -148.51 156.51 42.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.855 0.36 . . . . 0.0 110.873 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 6.0 t -110.01 144.13 39.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.817 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 9.8 p -62.44 147.2 11.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.058 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 147.48 -45.14 0.77 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.457 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 60.37 96.79 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.771 0.32 . . . . 0.0 110.846 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -164.47 68.52 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.804 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.76 112.54 4.58 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.895 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo -51.05 161.56 1.47 Allowed 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.457 2.105 . . . . 0.0 112.334 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -73.85 -27.8 12.0 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.653 2.235 . . . . 0.0 112.316 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -128.16 100.73 5.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.054 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.82 100.89 0.27 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.922 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -68.61 64.54 1.21 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.358 2.038 . . . . 0.0 112.319 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 12.6 mt -105.88 141.18 37.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.895 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -127.39 111.15 13.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.947 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.82 160.55 38.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.8 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -89.59 140.36 28.18 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.848 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -75.27 -44.87 0.29 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.462 2.108 . . . . 0.0 112.393 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 30.9 t -83.11 132.09 35.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.45 ' N ' ' CD ' ' A' ' 110' ' ' PRO . 0.5 OUTLIER -83.22 -52.19 0.63 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.064 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.45 ' CD ' ' N ' ' A' ' 109' ' ' SER . 41.1 Cg_exo -55.61 162.42 6.46 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.813 2.342 . . . . 0.0 112.218 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.461 ' N ' ' HD3' ' A' ' 112' ' ' PRO . . . -149.95 60.96 0.42 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.635 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.461 ' HD3' ' N ' ' A' ' 111' ' ' GLY . 12.4 Cg_exo -69.89 -164.83 0.14 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.679 2.252 . . . . 0.0 112.086 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 18.0 mp0 -116.76 143.81 32.14 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.768 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_exo -51.71 126.8 20.75 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.517 2.145 . . . . 0.0 112.345 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.8 mtp-105 -148.13 105.86 3.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.889 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -166.88 -51.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.89 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.626 HD23 ' HD3' ' A' ' 43' ' ' PRO . 23.1 tp -84.27 -64.12 1.22 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.84 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 58.04 30.09 18.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.962 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -165.43 119.89 1.26 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.833 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.569 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -83.0 166.86 18.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.136 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 17.7 mttm -117.76 103.77 10.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.92 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 8.1 m170 -101.56 101.99 12.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.042 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.433 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 2.9 t -90.03 139.43 17.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.868 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.2 p -54.83 -36.98 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.22 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.885 HD13 ' HB2' ' A' ' 39' ' ' LEU . 6.4 tp 62.71 30.71 16.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.003 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.542 ' HG3' HG21 ' A' ' 178' ' ' THR . 1.9 tptt -143.85 36.66 1.29 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.41 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.406 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER 177.27 -30.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.8 -179.832 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.438 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -55.3 -166.64 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.23 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.483 ' HA ' HG21 ' A' ' 176' ' ' ILE . 14.7 t80 -165.89 122.39 1.36 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.656 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.559 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.8 p -99.28 159.97 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.399 0.619 . . . . 0.0 111.657 -179.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.498 ' N ' HG22 ' A' ' 130' ' ' VAL . 4.5 p -160.81 154.58 22.42 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.562 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.66 100.14 5.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.905 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.08 172.85 7.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.849 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 26.3 p -79.29 179.96 7.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.973 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.645 HG21 ' CE1' ' A' ' 143' ' ' TYR . 1.7 m -143.01 101.4 5.31 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -49.69 -26.87 13.88 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.502 2.135 . . . . 0.0 112.471 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' THR . . . . . 0.484 ' OG1' HG22 ' A' ' 135' ' ' THR . 2.6 p -80.44 -31.53 37.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.901 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -151.25 91.79 3.86 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.842 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.26 83.14 2.2 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.459 2.106 . . . . 0.0 112.359 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.431 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.1 OUTLIER -177.2 -62.71 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.962 179.828 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.431 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 41.0 Cg_endo -67.07 -21.62 48.86 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.493 2.129 . . . . 0.0 112.401 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 61.09 156.18 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.983 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.645 ' CE1' HG21 ' A' ' 135' ' ' THR . 1.4 m-30 -106.18 112.48 25.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.922 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.691 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.4 OUTLIER -81.21 153.21 27.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.834 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.414 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.1 tt0 -158.77 137.78 11.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.511 HG12 HG21 ' A' ' 172' ' ' ILE . 4.5 mp -141.65 120.82 10.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.053 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.438 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 16.3 m -100.95 139.58 36.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.851 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -106.7 149.08 27.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.425 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.406 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.73 30.3 2.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.215 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -121.73 48.49 1.69 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.071 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.58 18.81 3.93 Favored Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.123 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.2 mm100 58.97 61.48 2.13 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.086 0.47 . . . . 0.0 111.005 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.5 165.54 15.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.552 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.96 96.56 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.219 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.8 m -91.85 127.09 44.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.266 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.414 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 0.2 OUTLIER -107.48 117.35 33.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.668 179.787 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.706 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.0 OUTLIER -124.72 161.3 26.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.029 -179.813 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.456 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -127.31 112.77 15.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.842 -179.903 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.959 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -71.05 172.92 8.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.094 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -80.77 -66.47 0.88 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.929 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -103.0 -178.36 3.64 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.886 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -75.84 -49.45 17.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.964 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -60.37 -36.69 78.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.151 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 66.3 m -67.62 -44.21 78.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.761 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.959 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -66.96 -37.9 85.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.809 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -73.68 -41.74 62.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.316 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 3.7 m -65.77 -32.73 74.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.924 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.497 ' CZ3' HD12 ' A' ' 34' ' ' LEU . 11.3 m95 -75.76 -54.88 6.25 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.57 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.691 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -57.44 -47.29 82.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.323 0.583 . . . . 0.0 110.407 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -60.46 -41.72 98.73 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.638 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.7 -40.19 73.0 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.855 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.693 HG22 HD12 ' A' ' 176' ' ' ILE . 17.3 mt -60.88 -24.39 32.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.559 ' N ' HG11 ' A' ' 130' ' ' VAL . 17.8 tt0 -80.61 -31.67 36.56 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.229 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -62.36 -48.83 78.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.241 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -67.89 -40.77 83.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.773 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.693 HD12 HG22 ' A' ' 172' ' ' ILE . 81.9 mt -77.6 -4.77 6.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.414 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -83.51 20.18 12.17 Favored Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.896 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 178' ' ' THR . . . . . 0.542 HG21 ' HG3' ' A' ' 126' ' ' LYS . 1.4 t . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.805 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.907 0.384 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.2 p -96.24 153.92 17.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.857 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 80.26 97.91 0.33 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.492 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -108.09 30.25 6.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.854 0.359 . . . . 0.0 110.973 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 58.81 78.25 0.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.926 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -147.9 96.96 3.97 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.99 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.421 ' HB3' ' HB2' ' A' ' 35' ' ' ALA . 36.9 Cg_exo -59.82 150.83 75.2 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.548 2.165 . . . . 0.0 112.237 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.6 ttt85 -93.49 129.62 39.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.488 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.624 HG22 ' HA ' ' A' ' 33' ' ' SER . 10.6 p -137.59 140.77 41.17 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.929 0.395 . . . . 0.0 111.198 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.18 135.1 6.25 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.367 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 11' ' ' LEU . 11.3 mt -58.64 108.17 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.936 0.398 . . . . 0.0 111.006 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 157' ' ' LEU . 0.0 OUTLIER -118.87 164.79 14.91 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.755 179.859 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -102.96 155.54 18.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.946 0.403 . . . . 0.0 111.019 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 156' ' ' PHE . 5.8 tp -133.96 135.17 43.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.614 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.477 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 31.0 ttp180 -69.59 166.84 18.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.803 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.0 t -142.95 163.76 31.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.789 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -163.82 -53.94 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.534 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -84.27 170.66 13.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.811 0.339 . . . . 0.0 111.088 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.58 -97.07 2.11 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.418 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.6 m -135.29 -177.13 4.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.819 0.342 . . . . 0.0 110.958 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.75 -159.09 14.15 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.461 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -171.11 171.03 5.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.825 0.345 . . . . 0.0 111.071 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.68 -69.71 3.25 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.466 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -169.6 -98.65 0.12 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.517 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -97.63 154.09 17.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.779 0.323 . . . . 0.0 111.042 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.1 ttt180 -137.27 71.37 1.4 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.838 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.477 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 45.1 m95 -48.2 166.2 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.168 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -154.59 -172.42 4.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.945 0.403 . . . . 0.0 111.058 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -109.7 121.84 46.13 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.048 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.686 HG12 ' HA ' ' A' ' 43' ' ' PRO . 30.6 m -140.51 124.28 17.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.094 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tp -69.72 120.86 16.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.567 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.691 HD12 HG13 ' A' ' 41' ' ' VAL . 7.5 tp -89.08 116.35 27.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.017 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.624 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.2 OUTLIER -96.58 89.36 4.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.676 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.707 HD12 ' HG ' ' A' ' 39' ' ' LEU . 1.2 tp -89.15 123.99 33.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.003 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.421 ' HB2' ' HB3' ' A' ' 7' ' ' PRO . . . -134.5 149.21 50.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.027 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.4 -16.87 50.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.46 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -92.32 -27.02 17.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.013 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.424 ' HA ' HD13 ' A' ' 125' ' ' LEU . . . -178.58 176.75 0.97 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.047 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.707 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -124.33 95.6 4.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.844 179.891 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 60.5 m -102.69 130.24 49.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.984 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.691 HG13 HD12 ' A' ' 32' ' ' LEU . 9.8 t -100.72 157.64 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.06 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.429 ' N ' HG12 ' A' ' 41' ' ' VAL . 15.8 p -147.33 154.15 45.23 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.603 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.686 ' HA ' HG12 ' A' ' 30' ' ' VAL . 71.9 Cg_endo -77.43 40.51 0.85 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.592 2.195 . . . . 0.0 112.779 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 54.79 27.01 8.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.191 0.52 . . . . 0.0 111.015 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.84 152.91 40.12 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.878 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.58 120.33 2.66 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.577 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.528 ' N ' ' CD ' ' A' ' 48' ' ' PRO . 1.3 mt-10 -81.74 -46.32 1.05 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 120.666 0.269 . . . . 0.0 111.357 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 47' ' ' GLU . 63.8 Cg_exo -50.93 144.43 27.52 Favored 'Trans proline' 0 C--O 1.233 0.237 0 C-N-CA 122.741 2.294 . . . . 0.0 112.388 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 70.12 150.94 0.58 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.499 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -68.44 179.82 2.78 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.536 2.157 . . . . 0.0 112.284 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -140.57 157.46 68.04 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.847 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.04 160.58 43.81 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.597 2.198 . . . . 0.0 112.224 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -56.88 108.98 1.4 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.998 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.87 -174.49 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.46 2.106 . . . . 0.0 112.35 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 62.92 144.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.193 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.538 ' C ' HD13 ' A' ' 57' ' ' LEU . 0.1 OUTLIER 60.01 -178.45 0.1 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.936 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.695 HD13 ' N ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -149.95 170.92 17.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.016 179.875 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -59.47 173.67 0.5 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.162 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -159.39 61.16 0.31 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.488 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.45 158.82 28.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.799 0.333 . . . . 0.0 111.138 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -117.82 49.2 1.26 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.019 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -135.55 114.31 11.26 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -51.75 -178.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.382 2.055 . . . . 0.0 112.329 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 173.09 -153.36 18.06 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.424 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -78.95 94.54 5.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.822 0.344 . . . . 0.0 111.164 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -127.5 88.36 53.92 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.033 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 161.01 47.59 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.535 2.157 . . . . 0.0 112.335 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.3 134.68 57.86 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.636 2.224 . . . . 0.0 112.312 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 62.51 144.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.972 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.431 ' N ' ' HD2' ' A' ' 71' ' ' PRO . 0.2 OUTLIER -72.77 -58.95 2.52 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.111 179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.431 ' HD2' ' N ' ' A' ' 70' ' ' LEU . 69.8 Cg_endo -75.55 143.66 27.62 Favored 'Trans proline' 0 N--CA 1.465 -0.182 0 C-N-CA 122.876 2.384 . . . . 0.0 112.379 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.571 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.1 mt-10 60.57 68.21 0.77 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.394 0.616 . . . . 0.0 110.696 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.571 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 163.62 -39.06 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.606 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 9.2 tt -90.32 -32.09 16.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.879 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.525 ' H ' HD12 ' A' ' 75' ' ' LEU . 5.5 mp -67.81 -41.78 82.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.926 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.5 tp -59.51 -56.08 26.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.98 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.9 48.21 1.33 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.977 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -84.25 -10.22 57.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.421 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -94.27 41.26 1.09 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.842 0.353 . . . . 0.0 111.015 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 23.7 t -143.04 -64.25 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 59.04 168.3 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -68.4 60.05 1.06 Allowed 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.863 2.375 . . . . 0.0 112.277 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -162.75 32.01 0.1 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.872 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -156.42 113.47 3.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.835 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -101.33 159.95 14.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.844 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -95.65 -31.9 13.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.901 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.6 m -66.31 -45.05 81.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -96.71 38.29 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.193 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.45 122.94 19.1 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.524 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -153.72 -137.06 2.4 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.478 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.0 t -145.25 146.93 31.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.73 0.3 . . . . 0.0 110.909 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.6 m -130.02 133.0 46.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.886 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.508 ' O ' HG13 ' A' ' 93' ' ' VAL . 12.1 p -61.89 118.66 4.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.052 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -166.73 84.55 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.525 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -131.95 39.13 3.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.871 0.367 . . . . 0.0 110.859 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -151.82 62.42 0.86 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.804 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 15.7 m -145.74 158.19 50.07 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.886 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -67.28 162.81 36.97 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.492 2.128 . . . . 0.0 112.321 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.45 -21.04 35.5 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.538 2.159 . . . . 0.0 112.442 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -104.98 160.38 15.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.192 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.9 156.14 65.61 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.761 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -69.02 171.19 14.08 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.535 2.157 . . . . 0.0 112.326 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 mp -61.44 121.86 13.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.927 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -110.05 -30.11 7.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.012 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -74.45 -75.47 0.16 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.927 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -177.91 148.39 0.66 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.968 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.73 -25.9 19.95 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.591 2.194 . . . . 0.0 112.35 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m 63.59 161.6 0.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.947 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.3 m -90.41 111.82 49.42 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.906 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.33 125.37 11.77 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.429 2.086 . . . . 0.0 112.309 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -151.78 -96.46 0.14 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.469 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.72 134.84 60.4 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.458 2.105 . . . . 0.0 112.233 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -81.3 110.35 18.1 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.812 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.63 136.95 31.88 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.439 2.093 . . . . 0.0 112.348 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 50.9 mtt180 -87.01 56.14 3.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.849 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.4 -63.1 1.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.908 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.504 HD13 HG11 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -147.81 106.93 3.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.027 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.1 m -123.21 -41.37 2.32 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.893 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.435 ' O ' ' HB3' ' A' ' 120' ' ' ALA . 0.2 OUTLIER -117.75 23.26 11.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.073 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.435 ' HB3' ' O ' ' A' ' 119' ' ' GLU . . . 69.42 157.75 0.16 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.036 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 12.6 mttm -106.81 81.08 1.52 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.008 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -72.24 93.63 1.49 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.873 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.49 HG13 ' HB2' ' A' ' 148' ' ' ALA . 21.5 t -88.2 111.21 22.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.207 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.29 129.06 38.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.844 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.522 HD23 ' O ' ' A' ' 175' ' ' GLN . 2.3 mp -88.9 -170.02 2.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.031 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.29 38.5 16.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.773 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.42 ' HG2' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -179.88 -38.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.858 179.956 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.73 -169.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.205 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -162.19 115.04 1.74 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.471 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.585 HG22 ' N ' ' A' ' 131' ' ' SER . 7.1 p -91.0 162.42 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.479 0.657 . . . . 0.0 111.793 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.585 ' N ' HG22 ' A' ' 130' ' ' VAL . 1.1 m -165.35 141.41 5.39 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.492 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.593 ' HD3' ' HB3' ' A' ' 169' ' ' ALA . 19.7 ptt85 -107.76 115.31 29.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.953 0.406 . . . . 0.0 111.043 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.466 ' O ' ' N ' ' A' ' 143' ' ' TYR . 2.8 mtp180 -118.64 -173.8 2.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.595 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' CYS . . . . . 0.462 ' C ' HG22 ' A' ' 135' ' ' THR . 0.8 OUTLIER -139.4 -178.85 5.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.995 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.636 HG23 ' HD3' ' A' ' 136' ' ' PRO . 0.2 OUTLIER -165.0 -58.35 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.341 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.43 179.944 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 136' ' ' PRO . . . . . 0.636 ' HD3' HG23 ' A' ' 135' ' ' THR . 88.6 Cg_exo -46.35 -66.79 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.425 2.084 . . . . 0.0 112.765 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.2 p -108.92 -9.06 15.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.804 0.335 . . . . 0.0 111.01 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.545 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 13.5 m-20 65.43 38.68 0.23 Allowed Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.139 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.545 ' CD ' ' N ' ' A' ' 138' ' ' ASP . 74.0 Cg_endo -76.97 -50.09 0.1 Allowed 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 121.903 1.735 . . . . 0.0 111.864 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.556 ' CB ' ' HD3' ' A' ' 141' ' ' PRO . 1.1 mt-10 163.76 -63.47 0.0 OUTLIER Pre-proline 0 CA--C 1.53 0.205 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.472 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.556 ' HD3' ' CB ' ' A' ' 140' ' ' GLU . 49.6 Cg_endo -90.38 85.59 0.39 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.824 2.349 . . . . 0.0 112.604 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -159.84 27.67 0.18 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.346 . . . . 0.0 111.473 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.466 ' N ' ' O ' ' A' ' 133' ' ' ARG . 19.3 t80 -177.5 83.2 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.946 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.11 108.77 12.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.712 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -111.88 144.13 41.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.501 HG12 HG23 ' A' ' 130' ' ' VAL . 19.6 mt -139.1 126.03 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.066 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.8 p -111.65 117.83 33.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.542 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -98.61 146.34 25.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.236 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.42 ' HB3' ' HG2' ' A' ' 127' ' ' MET . . . -96.05 31.68 2.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.237 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -115.33 44.62 1.8 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.33 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.56 24.21 2.42 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.484 -179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 58.33 60.09 2.76 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.985 0.421 . . . . 0.0 110.969 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.542 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 0.7 OUTLIER -91.7 151.98 20.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.739 179.918 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -155.05 90.0 1.25 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.247 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 10.4 m -89.21 127.58 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.075 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.518 ' O ' HD12 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -112.78 117.23 31.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.918 179.918 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.604 ' HB3' HD23 ' A' ' 12' ' ' LEU . 1.1 mp -126.62 168.69 13.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.437 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 1.7 ttp85 -142.32 118.2 10.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.954 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.847 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -78.05 172.67 13.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.037 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.99 -31.79 12.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -106.41 140.17 39.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.926 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -66.37 -42.85 87.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.085 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.88 -46.11 75.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.067 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.47 -49.53 77.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.62 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.847 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -58.25 -38.93 77.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.139 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 166' ' ' ARG . . . . . 0.405 ' HA ' ' HD3' ' A' ' 132' ' ' ARG . 1.6 ttt-85 -69.7 -47.79 61.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.532 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.64 -30.81 71.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.022 0.439 . . . . 0.0 110.249 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.676 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 6.0 m95 -72.13 -48.95 39.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.972 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.593 ' HB3' ' HD3' ' A' ' 132' ' ' ARG . . . -57.87 -54.55 45.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.283 0.564 . . . . 0.0 110.545 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.64 -36.96 80.98 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.642 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -72.84 -39.57 66.46 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 120.966 0.413 . . . . 0.0 110.615 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.511 HG12 HD13 ' A' ' 34' ' ' LEU . 11.9 mt -61.94 -22.74 29.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.5 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.7 OUTLIER -77.96 -44.77 25.79 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.532 179.644 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 174' ' ' ALA . . . . . 0.67 ' HA ' HG22 ' A' ' 178' ' ' THR . . . -64.82 -33.94 77.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.591 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 175' ' ' GLN . . . . . 0.522 ' O ' HD23 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -79.45 -29.84 41.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.981 179.174 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.455 ' CD1' HG22 ' A' ' 172' ' ' ILE . 6.1 mt -68.04 -28.93 42.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.53 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 112.73 34.72 1.82 Allowed Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.685 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 178' ' ' THR . . . . . 0.67 HG22 ' HA ' ' A' ' 174' ' ' ALA . 1.1 t . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.957 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.846 0.355 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.2 m -98.72 124.38 43.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.848 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.59 169.79 17.53 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.472 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.1 ttt-85 -127.53 104.98 8.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.851 0.357 . . . . 0.0 110.775 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.25 143.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.844 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.79 140.47 37.79 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.145 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.06 165.79 25.19 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.606 2.204 . . . . 0.0 112.278 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.609 ' CD ' HD23 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -107.7 153.5 22.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.683 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.777 HG22 ' HA ' ' A' ' 33' ' ' SER . 28.6 p -140.35 161.37 37.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.06 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -161.31 126.49 1.59 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.414 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.683 HD13 ' HE ' ' A' ' 29' ' ' ARG . 67.9 mt -60.32 110.46 1.25 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.744 0.307 . . . . 0.0 110.936 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.435 HD13 HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -121.45 132.54 54.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.87 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.37 149.6 47.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.818 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 58.0 tp -125.51 139.69 53.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.772 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.461 ' HA ' ' CD2' ' A' ' 27' ' ' TRP . 6.1 ttm180 -69.41 -178.06 1.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.445 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -168.52 -42.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.881 0.372 . . . . 0.0 110.993 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -78.87 145.12 28.31 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.624 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -110.02 105.49 14.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.767 0.318 . . . . 0.0 110.944 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.79 170.67 31.25 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.592 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 97.0 p -133.73 99.72 4.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.938 0.399 . . . . 0.0 110.911 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.04 -79.89 0.28 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.483 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -153.28 146.07 24.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.835 0.35 . . . . 0.0 111.108 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.04 -30.93 0.21 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.52 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 136.28 77.04 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.531 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -79.83 134.4 36.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.77 0.319 . . . . 0.0 110.92 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 39.2 mtp85 -100.35 139.74 35.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.812 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.477 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 28.0 m95 -149.15 117.61 6.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.86 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -102.11 -173.35 2.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.972 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.683 ' HE ' HD13 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -112.15 128.03 56.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.897 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.707 HG12 ' HA ' ' A' ' 43' ' ' PRO . 25.5 m -143.62 122.95 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.172 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tp -69.82 137.01 51.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.576 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.547 HD12 HG13 ' A' ' 41' ' ' VAL . 1.8 mp -106.81 109.92 21.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.14 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.777 ' HA ' HG22 ' A' ' 9' ' ' THR . 1.2 m -85.14 88.17 7.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.604 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.968 HD12 HD13 ' A' ' 39' ' ' LEU . 3.0 tp -79.76 131.36 35.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.191 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.59 145.51 38.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.913 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.46 -15.15 48.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.447 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -96.29 -24.02 16.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.046 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.741 ' HB1' ' O ' ' A' ' 123' ' ' VAL . . . -177.42 -178.68 0.78 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 0.0 111.153 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.968 HD13 HD12 ' A' ' 34' ' ' LEU . 30.4 tp -128.32 102.88 6.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.722 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.434 HG23 ' ND1' ' A' ' 122' ' ' HIS . 58.5 m -102.91 136.39 42.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.031 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.547 HG13 HD12 ' A' ' 32' ' ' LEU . 16.7 t -109.25 159.33 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.101 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.478 ' N ' HG12 ' A' ' 41' ' ' VAL . 11.9 t -160.08 149.29 14.1 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.495 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.736 ' HD3' HD23 ' A' ' 117' ' ' LEU . 74.3 Cg_endo -75.17 46.92 1.66 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.622 2.215 . . . . 0.0 112.907 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 46.95 29.41 1.03 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.972 0.415 . . . . 0.0 111.244 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -171.44 104.4 0.21 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.025 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -97.3 113.47 4.72 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.348 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -135.77 96.93 12.95 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.639 0.257 . . . . 0.0 110.914 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.0 -167.46 0.17 Allowed 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.39 2.06 . . . . 0.0 112.129 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -152.82 72.18 0.27 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.602 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.06 94.58 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.538 2.159 . . . . 0.0 112.258 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 60.92 80.31 0.26 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.827 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -77.69 175.73 10.88 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.585 2.19 . . . . 0.0 112.485 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -90.54 157.01 44.96 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.781 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.01 101.38 0.8 Allowed 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.557 2.171 . . . . 0.0 112.281 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.13 107.18 2.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.04 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 61.22 -171.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.814 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.8 mp -90.85 -71.17 0.64 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.872 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 16.8 m120 58.87 90.52 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.961 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -123.73 42.24 1.61 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.483 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -170.57 158.95 6.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.811 0.339 . . . . 0.0 111.098 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 61.45 153.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.013 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -58.51 109.71 2.05 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.035 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.15 142.99 39.03 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.454 2.103 . . . . 0.0 112.321 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -159.35 -161.63 11.38 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.471 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -136.33 68.46 1.44 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.823 0.344 . . . . 0.0 111.046 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -89.64 144.45 31.91 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.012 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -73.83 110.85 3.16 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.548 2.165 . . . . 0.0 112.483 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -76.5 167.85 24.84 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.5 2.133 . . . . 0.0 112.278 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.867 ' O ' HD23 ' A' ' 70' ' ' LEU . 14.0 pt20 -78.92 152.38 31.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.955 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.867 HD23 ' O ' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -156.01 -63.54 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.075 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.465 ' HD2' ' H ' ' A' ' 70' ' ' LEU . 21.6 Cg_endo -61.95 -166.73 0.05 OUTLIER 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.693 2.262 . . . . 0.0 112.152 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.545 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 1.7 mt-10 65.85 71.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.36 0.6 . . . . 0.0 110.725 -179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 168.12 -41.03 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.891 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -112.58 -32.89 6.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.195 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.948 HD13 ' N ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -61.33 -16.98 51.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.401 -179.723 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.948 ' N ' HD13 ' A' ' 75' ' ' LEU . 0.1 OUTLIER -90.24 3.05 54.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.262 -179.968 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -140.94 38.57 1.79 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.829 0.347 . . . . 0.0 110.968 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -88.51 -57.11 3.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.986 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -92.65 47.12 1.27 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.916 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 4.8 t -128.85 -57.0 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.866 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.463 ' CB ' ' HD2' ' A' ' 82' ' ' PRO . 0.3 OUTLIER -96.22 174.1 3.67 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.615 179.914 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.463 ' HD2' ' CB ' ' A' ' 81' ' ' SER . 63.2 Cg_endo -74.22 59.72 4.63 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.38 2.054 . . . . 0.0 112.156 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.9 t80 71.9 77.81 0.16 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.825 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -76.02 122.91 24.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.909 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -151.83 159.18 43.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -56.87 156.48 6.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.997 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -99.61 160.87 13.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.958 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 59.86 82.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.095 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 173.3 133.61 1.7 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.508 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 109.34 -99.89 1.3 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.522 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.7 t -118.4 -40.86 2.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.715 0.293 . . . . 0.0 110.886 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 61.04 159.16 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.857 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.2 p -85.6 136.53 22.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.106 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 140.65 80.53 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.509 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 6.6 m0 -113.76 34.29 4.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.874 0.369 . . . . 0.0 110.915 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -110.71 40.71 1.94 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.939 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.1 t 62.83 89.3 0.11 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.928 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.46 128.63 16.59 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.653 2.235 . . . . 0.0 112.169 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.24 -27.97 86.43 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.362 2.041 . . . . 0.0 112.121 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.46 175.22 5.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.175 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.4 t -149.18 88.65 5.03 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.885 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -51.26 148.22 19.26 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.637 2.225 . . . . 0.0 112.395 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.423 ' C ' HD12 ' A' ' 103' ' ' LEU . 2.4 pp -166.81 33.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.87 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -72.58 124.49 25.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.28 135.27 45.23 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.832 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -103.44 92.21 3.84 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.816 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -68.18 66.73 1.01 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.418 2.079 . . . . 0.0 112.231 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.1 m -125.52 73.99 1.36 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.869 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.8 t 60.7 79.47 0.28 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.871 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.13 138.23 33.09 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.572 2.181 . . . . 0.0 112.232 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.13 -178.28 19.35 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.457 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -53.83 -171.54 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.649 2.232 . . . . 0.0 112.313 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -130.78 118.06 17.59 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.934 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.37 -170.81 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.354 2.036 . . . . 0.0 112.29 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 -141.53 -177.69 5.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.952 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.3 p-10 -59.54 -50.42 73.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.965 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.736 HD23 ' HD3' ' A' ' 43' ' ' PRO . 20.7 tp -90.75 -68.78 0.77 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.924 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 5.9 t 50.69 27.01 2.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.203 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -161.69 118.25 2.14 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.844 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.22 140.07 58.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.023 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -101.33 88.88 3.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.054 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.434 ' ND1' HG23 ' A' ' 40' ' ' THR . 0.2 OUTLIER -76.69 109.01 10.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.932 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.741 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 21.5 t -109.89 150.84 12.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.102 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 87.1 p -87.48 157.24 19.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.906 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.4 ' HA ' HD12 ' A' ' 125' ' ' LEU . 1.5 tp -120.67 31.75 6.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.923 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -133.39 38.38 3.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.707 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.765 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 1.4 mtt 177.6 -34.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.874 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.459 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -55.0 -171.53 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.988 0.423 . . . . 0.0 111.31 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -168.44 116.56 0.7 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.434 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.557 HG11 ' N ' ' A' ' 173' ' ' GLN . 1.9 p -88.04 158.47 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.314 0.578 . . . . 0.0 111.579 -179.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.467 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 93.6 p -168.48 159.2 10.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.756 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 16.8 ptt85 -132.89 126.59 32.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.042 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -148.54 172.7 14.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.804 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -120.8 -176.46 3.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.944 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.574 HG23 ' HD3' ' A' ' 136' ' ' PRO . 0.4 OUTLIER -138.69 -62.46 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.257 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 136' ' ' PRO . . . . . 0.574 ' HD3' HG23 ' A' ' 135' ' ' THR . 81.7 Cg_endo -83.95 -8.24 10.1 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.176 1.917 . . . . 0.0 112.578 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' THR . . . . . 0.509 HG23 ' C ' ' A' ' 136' ' ' PRO . 1.2 p 70.88 32.97 2.28 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.992 0.425 . . . . 0.0 110.732 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.502 ' H ' ' HD2' ' A' ' 139' ' ' PRO . 0.4 OUTLIER -111.57 -68.66 0.03 OUTLIER Pre-proline 0 CA--C 1.531 0.238 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.326 -179.832 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.502 ' HD2' ' H ' ' A' ' 138' ' ' ASP . 18.5 Cg_endo -58.95 98.71 0.1 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.191 1.927 . . . . 0.0 112.408 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.453 ' N ' ' CD ' ' A' ' 141' ' ' PRO . 0.2 OUTLIER -48.37 -50.03 59.52 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.127 179.85 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 140' ' ' GLU . 72.0 Cg_exo -48.83 -24.41 7.04 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.582 2.188 . . . . 0.0 112.555 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 8.1 mtt85 65.31 153.37 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.906 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.418 ' CD2' ' HD3' ' A' ' 158' ' ' ARG . 58.3 m-85 -82.25 127.6 33.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.942 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 1.045 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.3 OUTLIER -84.96 112.67 20.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.71 179.888 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.423 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.8 tt0 -108.12 131.23 54.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.986 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.405 HG12 HG23 ' A' ' 130' ' ' VAL . 35.6 mt -132.32 110.98 17.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.189 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.459 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 30.7 p -91.66 155.36 18.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.908 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.804 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -132.89 145.83 51.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.105 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.765 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -94.54 30.51 1.98 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.289 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -119.41 47.04 1.77 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.171 0.51 . . . . 0.0 110.115 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.23 17.06 4.57 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.266 -179.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' GLN . . . . . 0.4 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 2.8 mm-40 61.11 63.95 1.18 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.049 0.452 . . . . 0.0 110.91 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.804 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 28.1 m-20 -91.07 162.69 14.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.818 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.28 96.04 0.48 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.157 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 9.4 m -90.63 124.97 43.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.199 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.423 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 0.5 OUTLIER -105.96 87.13 2.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.807 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.46 HD13 HD21 ' A' ' 32' ' ' LEU . 2.2 mt -99.86 171.25 7.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.98 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.418 ' HD3' ' CD2' ' A' ' 143' ' ' TYR . 6.5 ttp85 -143.58 116.33 8.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.884 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -70.84 172.87 8.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.205 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.74 -31.38 13.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.009 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -110.89 157.52 19.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.868 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -73.83 -57.12 4.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.851 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -61.08 -32.45 72.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.075 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 2.9 m -64.62 -52.58 56.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.8 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.884 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -59.67 -36.89 77.35 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.051 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -45.23 60.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.365 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 59.8 p -66.52 -32.4 73.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.1 179.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.592 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.1 m95 -72.56 -49.88 29.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.743 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 1.045 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -58.92 -47.33 85.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.314 0.578 . . . . 0.0 110.385 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -59.7 -40.89 97.13 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.525 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.91 -40.29 72.24 Favored 'General case' 0 CA--C 1.51 -0.592 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.894 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.863 HG22 HD12 ' A' ' 176' ' ' ILE . 10.9 mt -60.98 -24.51 33.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 177.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.557 ' N ' HG11 ' A' ' 130' ' ' VAL . 19.5 tt0 -85.3 -25.91 26.91 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.507 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.83 -42.49 73.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.196 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -76.01 -39.99 54.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.814 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.863 HD12 HG22 ' A' ' 172' ' ' ILE . 67.4 mt -80.7 -9.46 12.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.362 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -86.2 26.1 6.49 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.449 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.6 t . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.171 -0.919 . . . . 0.0 111.011 179.951 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.836 0.351 . . . . 0.0 111.081 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.4 p -109.69 -178.12 3.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -87.17 -37.4 8.33 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.472 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.46 154.32 46.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.782 0.325 . . . . 0.0 110.926 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.2 158.94 15.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -125.88 84.06 61.67 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.027 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.13 142.16 45.59 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.623 2.215 . . . . 0.0 112.45 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -86.26 136.63 33.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.697 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.738 HG22 ' HA ' ' A' ' 33' ' ' SER . 34.0 p -136.45 148.39 47.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.954 0.407 . . . . 0.0 111.35 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.26 162.36 30.15 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.194 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.802 HD13 ' NH1' ' A' ' 29' ' ' ARG . 7.3 mt -82.98 132.93 35.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.791 0.329 . . . . 0.0 110.989 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.627 HD22 ' CB ' ' A' ' 157' ' ' LEU . 0.2 OUTLIER -146.87 145.52 29.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.738 179.815 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -79.84 158.33 26.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.104 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 12.6 tp -141.89 128.97 20.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.411 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.469 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 29.5 ttp180 -69.59 67.0 0.22 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.894 0.378 . . . . 0.0 110.904 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.04 169.25 1.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.901 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -177.48 137.28 3.38 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.511 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -163.79 143.63 8.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.859 0.361 . . . . 0.0 111.124 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 139.41 -145.52 16.72 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.477 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 p -123.07 139.93 53.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.811 0.339 . . . . 0.0 110.954 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.18 -135.06 12.0 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.454 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.06 -45.68 0.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.922 0.392 . . . . 0.0 111.172 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -87.49 84.69 1.52 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.471 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 177.94 62.7 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.514 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -87.3 152.77 22.0 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.873 0.368 . . . . 0.0 110.926 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.2 mtp180 -138.32 115.37 10.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.915 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.469 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 39.6 m95 -69.23 163.71 24.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.934 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -160.74 152.66 19.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.959 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.802 ' NH1' HD13 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -77.54 120.14 22.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.921 179.903 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.401 HG21 ' HB2' ' A' ' 14' ' ' LEU . 33.3 m -130.1 133.86 63.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.062 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 12.0 tp -74.7 143.34 44.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.758 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.555 HD13 ' HB2' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -111.33 137.03 49.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.957 -179.845 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.738 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.8 OUTLIER -118.56 94.4 4.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.799 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.486 HD22 HD13 ' A' ' 172' ' ' ILE . 7.6 tp -89.31 115.3 26.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.962 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.406 ' N ' HD12 ' A' ' 34' ' ' LEU . . . -117.89 149.11 41.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.702 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.82 -15.54 31.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.31 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.401 ' O ' ' HB2' ' A' ' 38' ' ' ALA . 3.2 p30 -95.29 -26.85 15.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.236 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.681 ' HA ' HD13 ' A' ' 125' ' ' LEU . . . 179.05 171.65 0.86 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.806 0.336 . . . . 0.0 111.302 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.582 ' HB3' HG23 ' A' ' 123' ' ' VAL . 3.2 tm? -106.25 115.42 30.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.709 179.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.8 m -116.72 123.38 47.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.15 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.541 HG13 HD12 ' A' ' 32' ' ' LEU . 16.9 t -103.81 159.58 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.894 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.49 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.4 OUTLIER -167.34 166.47 8.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.783 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.407 ' HD3' HD22 ' A' ' 117' ' ' LEU . 34.6 Cg_endo -64.52 148.26 90.54 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.577 2.185 . . . . 0.0 112.259 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.578 ' HB1' HD21 ' A' ' 11' ' ' LEU . . . -98.41 45.66 1.01 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.054 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -88.38 66.99 8.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.905 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 69.0 164.87 3.75 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.485 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -96.91 103.34 14.56 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.61 0.243 . . . . 0.0 110.967 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.0 121.5 7.92 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.442 2.095 . . . . 0.0 112.25 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 143.5 -68.86 0.43 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.519 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.5 54.32 4.97 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.695 2.263 . . . . 0.0 112.534 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 178.26 75.34 0.13 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.804 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -51.47 167.23 0.4 Allowed 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.633 2.222 . . . . 0.0 112.408 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.92 70.18 0.98 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.873 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -57.66 142.98 95.96 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.501 2.134 . . . . 0.0 112.191 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -162.47 123.73 2.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.165 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -114.32 143.37 44.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.806 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -165.41 38.25 0.06 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.931 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -117.46 104.99 11.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.884 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -160.86 30.93 0.35 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.617 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -124.14 122.65 38.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.844 0.354 . . . . 0.0 111.147 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.96 140.43 55.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.033 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.92 162.25 44.72 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.999 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -68.23 107.15 1.5 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.524 2.15 . . . . 0.0 112.316 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.36 70.36 0.29 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.571 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -92.32 76.09 5.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.87 0.366 . . . . 0.0 110.922 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.764 ' HB3' ' HD3' ' A' ' 67' ' ' PRO . . . -179.2 -61.76 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.242 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.764 ' HD3' ' HB3' ' A' ' 66' ' ' ALA . 43.2 Cg_endo -69.37 152.56 71.31 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.843 2.362 . . . . 0.0 112.277 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -73.71 150.91 45.7 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.661 2.241 . . . . 0.0 112.365 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -140.26 109.38 6.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.918 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.537 ' H ' HD12 ' A' ' 70' ' ' LEU . 1.3 mp -81.65 -46.54 1.06 Allowed Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.696 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 70' ' ' LEU . 90.9 Cg_endo -81.87 -168.2 0.58 Allowed 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.619 2.212 . . . . 0.0 112.505 -179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 65.79 72.63 0.4 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.495 0.664 . . . . 0.0 110.528 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 178.88 -48.82 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.866 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 10.2 mp -88.37 -27.64 21.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.871 178.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.869 HD22 ' O ' ' A' ' 75' ' ' LEU . 0.1 OUTLIER -75.39 -34.62 61.1 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.223 179.479 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.582 ' N ' HD13 ' A' ' 75' ' ' LEU . 0.7 OUTLIER -87.73 51.84 2.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.981 179.823 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -115.08 30.38 7.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.02 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -78.46 -48.77 14.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.993 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -85.5 57.36 4.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.777 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.4 t -135.15 -46.81 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.191 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.485 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -80.4 -49.83 1.15 Allowed Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.15 -179.912 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 81' ' ' SER . 48.5 Cg_endo -93.37 -141.44 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.09 0 C-N-CA 123.684 2.923 . . . . 0.0 111.653 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -69.95 161.1 30.66 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.864 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -129.21 159.46 36.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.997 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 9.3 mttp -122.68 -41.09 2.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.004 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 64.38 173.34 0.19 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.933 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.8 p -139.29 -52.48 0.55 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.915 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -77.72 -36.32 51.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.068 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -98.92 -152.36 27.53 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.479 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 96.88 -44.19 1.95 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.462 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.9 t -144.68 154.16 42.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.833 0.349 . . . . 0.0 110.807 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.48 138.55 36.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.92 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.3 p -80.88 129.65 37.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.082 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 170.82 93.74 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.508 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 60.29 80.08 0.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.752 0.31 . . . . 0.0 110.876 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -179.64 75.46 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.74 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 86.7 p -67.47 135.51 93.03 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.783 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.93 112.44 3.5 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.509 2.139 . . . . 0.0 112.323 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -56.07 -27.44 64.73 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.401 2.067 . . . . 0.0 112.282 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.15 -174.25 4.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.1 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -157.57 165.06 19.52 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.902 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.79 -179.35 1.27 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.525 2.15 . . . . 0.0 112.251 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 12.7 mt 61.29 155.05 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.883 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -129.28 -45.47 1.23 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.872 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.71 36.0 16.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.899 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.22 130.91 21.43 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.873 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.19 107.28 0.19 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.431 2.088 . . . . 0.0 112.232 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.2 m -88.18 -46.67 9.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.966 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.2 m 61.08 155.75 0.11 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.803 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -66.84 144.85 72.66 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.533 2.155 . . . . 0.0 112.217 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -179.69 -80.41 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.537 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.78 159.9 4.51 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.532 2.155 . . . . 0.0 112.272 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.8 119.82 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.904 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.75 166.2 0.92 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.371 2.048 . . . . 0.0 112.245 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 69.8 mtt85 -90.21 154.2 19.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.953 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -92.16 -51.36 5.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.875 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.407 HD22 ' HD3' ' A' ' 43' ' ' PRO . 0.5 OUTLIER -123.3 87.16 2.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.916 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.0 m -95.28 -33.08 12.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.837 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -97.16 148.52 22.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.93 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.481 ' HB3' ' NE2' ' A' ' 122' ' ' HIS . . . -96.75 166.46 11.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.106 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -105.52 92.55 4.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.834 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.481 ' NE2' ' HB3' ' A' ' 120' ' ' ALA . 7.3 m-70 -93.77 109.49 21.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.198 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.593 HG12 ' CB ' ' A' ' 148' ' ' ALA . 0.6 OUTLIER -116.55 121.83 68.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.762 179.64 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 10.6 t -56.57 140.09 47.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.826 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.681 HD13 ' HA ' ' A' ' 38' ' ' ALA . 1.9 mp -97.39 31.11 2.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.981 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 mtmm -133.65 32.18 3.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.531 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.584 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -177.55 -36.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.83 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.561 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -54.94 -172.34 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.172 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -168.77 120.65 0.78 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.843 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.578 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.0 p -94.38 159.12 2.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.196 0.522 . . . . 0.0 111.123 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.468 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 13.6 t -164.46 155.11 14.85 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.846 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 21.2 ttp180 -121.52 84.04 2.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.642 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.02 163.36 26.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.899 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 1.3 t -110.49 140.18 45.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.895 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.81 164.28 47.48 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.773 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.07 -15.49 48.79 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.57 2.18 . . . . 0.0 112.48 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 43.9 p -96.68 -31.85 12.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.846 0.355 . . . . 0.0 110.943 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 60.14 65.76 2.2 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.887 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -63.24 -66.32 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.619 2.213 . . . . 0.0 112.346 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.428 ' N ' ' HD2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER 179.18 -61.09 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.998 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' A' ' 140' ' ' GLU . 39.5 Cg_endo -66.81 -10.44 28.27 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.577 2.185 . . . . 0.0 112.688 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? 66.1 -173.94 0.18 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.796 0.331 . . . . 0.0 111.028 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -108.33 118.21 36.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.056 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 1.042 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.9 OUTLIER -96.79 119.61 35.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.695 179.662 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.428 ' HG3' ' CE1' ' A' ' 156' ' ' PHE . 9.0 tt0 -125.81 138.22 53.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.066 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.507 HD13 HG21 ' A' ' 172' ' ' ILE . 14.2 mt -134.95 112.8 15.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.073 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.561 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 18.5 m -88.48 162.07 16.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.03 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.687 ' HB3' ' HB3' ' A' ' 153' ' ' ASP . . . -144.09 146.51 32.86 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.171 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.584 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.03 30.24 2.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.337 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.22 45.47 1.76 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.131 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 117.05 23.01 4.03 Favored Glycine 0 N--CA 1.449 -0.459 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.14 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 58.78 61.93 2.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 121.096 0.474 . . . . 0.0 110.84 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.687 ' HB3' ' HB3' ' A' ' 148' ' ' ALA . 20.2 t0 -88.66 161.95 16.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.883 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -168.38 89.82 0.26 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.144 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.481 HG22 ' HB ' ' A' ' 146' ' ' ILE . 30.2 m -77.5 132.89 31.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.127 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.428 ' CE1' ' HG3' ' A' ' 145' ' ' GLU . 68.0 m-85 -111.03 92.04 3.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.647 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.627 ' CB ' HD22 ' A' ' 12' ' ' LEU . 1.8 mt -104.04 160.19 15.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.19 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.468 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 2.9 ttt180 -133.38 97.17 3.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.828 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.948 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -54.34 171.28 0.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.247 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.85 -31.05 11.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.841 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -108.36 171.53 7.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.861 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.27 -55.65 3.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.967 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.41 -28.17 68.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.206 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -52.27 37.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.7 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.948 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -61.47 -37.43 83.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.949 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -73.19 -44.04 60.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.311 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 24.8 t -66.42 -33.24 75.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.874 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.444 ' O ' HG12 ' A' ' 172' ' ' ILE . 11.5 m95 -72.5 -52.49 15.49 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.75 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 1.042 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -56.24 -45.87 79.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.291 0.567 . . . . 0.0 110.467 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.9 -44.54 96.01 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.527 -0.761 . . . . 0.0 112.734 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.09 -40.81 82.57 Favored 'General case' 0 CA--C 1.51 -0.571 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.176 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.785 HG22 HD12 ' A' ' 176' ' ' ILE . 20.8 mm -60.4 -24.91 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.578 ' N ' HG11 ' A' ' 130' ' ' VAL . 30.8 tt0 -83.63 -26.15 30.18 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.571 179.416 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.66 -49.31 63.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.21 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 175' ' ' GLN . . . . . 0.657 ' HB3' HD23 ' A' ' 125' ' ' LEU . 1.9 mp0 -69.65 -41.26 75.82 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.787 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.785 HD12 HG22 ' A' ' 172' ' ' ILE . 67.5 mt -80.05 -3.03 5.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.378 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -87.0 25.3 7.78 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.643 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.3 t . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.362 -0.828 . . . . 0.0 110.95 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.813 0.34 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m 60.76 177.13 0.1 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.971 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 148.44 -110.18 0.48 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.459 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.05 40.64 14.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.837 0.351 . . . . 0.0 110.932 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.3 mmt180 -142.59 103.32 4.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.858 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -132.13 90.71 34.13 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.149 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.55 156.42 63.94 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.598 2.199 . . . . 0.0 112.351 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.44 146.19 36.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.786 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.881 HG22 ' HA ' ' A' ' 33' ' ' SER . 58.8 p -140.44 152.95 46.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.095 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -158.63 123.9 1.31 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.328 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 18.4 mt -64.28 100.73 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.875 0.369 . . . . 0.0 110.926 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.759 HD13 HD22 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -106.61 170.03 8.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.895 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.536 ' O ' HD23 ' A' ' 157' ' ' LEU . 0.2 OUTLIER -107.88 155.97 19.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.979 -179.971 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 13.2 tp -134.37 127.8 32.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.638 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.43 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.7 OUTLIER -69.35 175.2 4.12 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.852 -179.539 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.5 t -166.79 98.14 0.55 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.95 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -150.68 66.16 0.36 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.515 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.21 179.99 3.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.843 0.354 . . . . 0.0 111.101 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.05 53.74 3.61 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.503 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.76 -55.8 3.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.854 0.359 . . . . 0.0 110.86 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 174.07 -48.81 0.15 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.461 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -99.16 89.56 4.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.799 0.333 . . . . 0.0 111.137 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -104.29 82.02 0.35 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.465 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -122.24 36.34 3.21 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.518 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 60.83 88.24 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.874 0.369 . . . . 0.0 110.906 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.1 63.03 0.75 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.788 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.477 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 46.6 m95 -58.7 160.28 5.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.962 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -147.39 152.61 38.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.018 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -80.63 121.32 25.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.041 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.666 HG12 ' HA ' ' A' ' 43' ' ' PRO . 31.9 m -134.52 137.82 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.135 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tp -86.16 127.8 34.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.616 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.759 HD22 HD13 ' A' ' 12' ' ' LEU . 0.9 OUTLIER -100.16 103.44 14.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.015 -179.768 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.881 ' HA ' HG22 ' A' ' 9' ' ' THR . 2.7 m -82.24 78.57 8.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.657 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.848 HD12 ' HG ' ' A' ' 39' ' ' LEU . 3.6 tp -74.48 93.29 2.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.17 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.46 147.8 22.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.916 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.2 -14.76 52.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.512 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.41 -17.33 14.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.237 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.423 ' C ' HD22 ' A' ' 125' ' ' LEU . . . -174.23 173.71 3.02 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.78 0.324 . . . . 0.0 111.128 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.848 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -121.37 104.63 9.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.895 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.3 m -101.45 155.03 18.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.041 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.643 HG13 HD12 ' A' ' 32' ' ' LEU . 16.2 t -138.78 159.11 30.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.147 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.485 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -165.19 158.33 13.92 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.542 179.92 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.666 ' HA ' HG12 ' A' ' 30' ' ' VAL . 6.6 Cg_exo -73.85 42.02 0.68 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.768 2.312 . . . . 0.0 112.78 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 46.05 29.83 0.84 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.032 0.444 . . . . 0.0 111.302 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -84.78 149.52 25.69 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.911 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -85.71 67.57 3.55 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.415 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -80.58 131.78 60.23 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.574 0.226 . . . . 0.0 110.765 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -53.41 144.07 51.88 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.438 2.092 . . . . 0.0 112.26 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -99.16 -74.27 1.13 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.49 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.83 113.03 3.41 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.64 2.227 . . . . 0.0 112.336 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 60.84 83.3 0.21 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.048 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.79 108.37 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.522 2.148 . . . . 0.0 112.284 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.51 143.67 97.83 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.921 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -73.91 150.36 43.75 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.531 2.154 . . . . 0.0 112.325 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 59.27 -169.11 0.14 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.2 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -157.49 53.24 0.48 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.968 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.63 HD13 ' H ' ' A' ' 58' ' ' ASN . 0.2 OUTLIER 62.1 151.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.901 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.63 ' H ' HD13 ' A' ' 57' ' ' LEU . 34.5 p30 -129.12 62.88 1.5 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.872 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.481 ' O ' HD12 ' A' ' 57' ' ' LEU . . . 136.98 141.42 4.25 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.524 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -144.17 177.65 8.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.814 0.34 . . . . 0.0 111.121 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -150.46 145.8 26.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.124 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -136.88 154.42 76.22 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.853 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.48 113.52 2.52 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.507 2.138 . . . . 0.0 112.267 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.19 -109.03 2.74 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.473 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -160.54 118.55 2.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.812 0.339 . . . . 0.0 111.083 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.57 159.4 84.69 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.026 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.21 159.04 4.54 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.531 2.154 . . . . 0.0 112.351 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.01 179.85 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.61 2.207 . . . . 0.0 112.25 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -86.22 134.8 33.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.856 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.2 mp -70.57 168.54 19.02 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.766 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -56.39 -165.02 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.537 2.158 . . . . 0.0 112.269 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.7 mt-10 64.94 70.99 0.46 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.3 0.571 . . . . 0.0 110.72 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 167.82 -46.26 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.735 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.409 ' N ' HD12 ' A' ' 74' ' ' LEU . 7.8 mp -93.67 -34.64 13.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.941 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.671 HD12 ' N ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -64.31 -15.7 60.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.444 -179.912 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.671 ' N ' HD12 ' A' ' 75' ' ' LEU . 0.4 OUTLIER -91.21 -35.11 14.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.825 0.345 . . . . 0.0 110.869 179.961 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -109.56 82.96 1.68 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.954 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -110.62 -7.13 14.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.397 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.51 39.87 1.12 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.985 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.2 t -127.56 -28.19 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.528 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.471 ' N ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -52.85 -52.68 62.54 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.742 -179.703 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.471 ' HD2' ' N ' ' A' ' 81' ' ' SER . 73.6 Cg_endo -78.78 53.27 4.57 Favored 'Trans proline' 0 N--CA 1.465 -0.192 0 C-N-CA 122.894 2.396 . . . . 0.0 113.01 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 42.44 31.87 0.31 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.66 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -102.85 160.9 14.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.809 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.8 mttt -114.93 -68.42 0.92 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.997 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -169.21 -43.0 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.3 p -149.59 31.02 0.73 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.896 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 58.91 88.61 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.089 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -170.68 62.8 0.17 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.534 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -137.42 -170.13 11.81 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.562 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.8 t -134.15 152.97 52.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.762 0.315 . . . . 0.0 110.897 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.84 143.47 57.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.905 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.15 149.92 11.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.087 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -132.09 -82.12 0.22 Allowed Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.487 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER 59.77 78.6 0.26 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.87 0.367 . . . . 0.0 110.834 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -157.31 31.67 0.28 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.956 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.1 m -108.46 129.9 23.44 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.86 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.501 ' N ' ' CD ' ' A' ' 99' ' ' PRO . 31.9 Cg_exo -56.58 -45.91 33.7 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.358 2.038 . . . . 0.0 112.634 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.501 ' CD ' ' N ' ' A' ' 98' ' ' PRO . 83.1 Cg_endo -85.13 51.75 3.16 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.943 2.429 . . . . 0.0 112.393 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.16 102.95 11.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.082 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 2.3 t -110.55 87.21 6.23 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.936 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -68.52 81.42 0.56 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.559 2.173 . . . . 0.0 112.301 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.415 ' O ' HD12 ' A' ' 103' ' ' LEU . 2.5 pp -170.63 117.03 0.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.935 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -160.92 30.56 0.15 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.927 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 2.1 mtm180 -137.93 131.26 30.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.819 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.461 ' CB ' ' CD ' ' A' ' 107' ' ' PRO . 9.8 mm100 -160.85 -65.65 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.958 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 106' ' ' GLN . 55.9 Cg_endo -69.93 -9.89 27.13 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.341 2.027 . . . . 0.0 112.611 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.2 p -56.85 154.48 9.24 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.802 0.334 . . . . 0.0 111.003 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -106.08 116.91 58.75 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.816 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -73.94 155.01 48.3 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.502 2.135 . . . . 0.0 112.454 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 147.38 71.97 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.586 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -63.63 76.04 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.705 2.27 . . . . 0.0 112.188 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -102.18 133.13 20.8 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.873 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.48 175.5 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.409 2.073 . . . . 0.0 112.245 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.44 94.75 9.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.874 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.867 ' HB3' HD23 ' A' ' 117' ' ' LEU . 2.9 m120 -139.55 -75.19 0.36 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.888 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.867 HD23 ' HB3' ' A' ' 116' ' ' ASN . 0.5 OUTLIER -151.16 123.5 8.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.959 -179.973 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 43.4 m -110.18 -31.4 7.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.806 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.84 22.62 10.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.143 0.497 . . . . 0.0 111.148 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . 63.35 143.19 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.181 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.519 ' HE2' HG13 ' A' ' 155' ' ' VAL . 5.5 tttp -84.47 95.28 8.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.767 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -91.16 103.11 15.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.089 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 39' ' ' LEU . 6.6 t -81.81 118.06 28.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.725 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -49.25 -34.55 15.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.516 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.614 HD13 ' HB2' ' A' ' 39' ' ' LEU . 3.8 tp 60.22 -165.21 0.21 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.665 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 54.88 38.78 30.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.991 0.424 . . . . 0.0 110.773 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.7 mtt 173.42 -30.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.762 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.06 -167.75 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.296 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.448 ' CD1' ' N ' ' A' ' 129' ' ' TYR . 0.0 OUTLIER -159.77 120.13 3.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.62 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.657 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.4 p -94.52 159.53 2.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.31 0.576 . . . . 0.0 111.272 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.481 ' N ' HG22 ' A' ' 130' ' ' VAL . 1.0 OUTLIER -169.1 125.46 0.92 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.862 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 -95.89 86.65 4.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.967 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -73.75 -179.77 3.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.881 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 20.5 m -134.75 116.34 14.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.844 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.413 HG23 ' CD1' ' A' ' 143' ' ' TYR . 7.4 p -59.32 156.17 31.4 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.978 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_exo -51.32 -25.17 17.45 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.67 2.247 . . . . 0.0 112.405 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 48.5 p -83.48 -41.15 18.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.998 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 56.55 62.58 6.25 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.975 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.01 -54.85 0.29 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.419 2.08 . . . . 0.0 112.58 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.47 ' N ' ' HD2' ' A' ' 141' ' ' PRO . 0.5 OUTLIER 176.22 -61.54 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.223 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 140' ' ' GLU . 12.2 Cg_endo -55.72 -20.73 29.26 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.547 2.165 . . . . 0.0 112.47 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 66.18 -166.69 0.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.743 0.306 . . . . 0.0 110.852 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.413 ' CD1' HG23 ' A' ' 135' ' ' THR . 0.1 OUTLIER -118.9 120.31 36.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.849 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.465 HD11 ' HA ' ' A' ' 165' ' ' ALA . 0.2 OUTLIER -99.17 109.2 21.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.734 179.95 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -114.36 142.32 46.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.735 HD13 HG21 ' A' ' 172' ' ' ILE . 24.0 mt -146.31 107.18 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.91 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 11.7 m -92.77 133.38 36.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.052 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.68 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -108.5 150.21 27.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.406 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.24 30.69 2.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.294 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -116.3 45.78 1.71 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.075 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.22 23.49 3.2 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.145 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 57.16 59.59 3.34 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.07 0.462 . . . . 0.0 111.084 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.68 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.8 m-20 -85.74 158.61 19.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.545 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -157.98 91.66 1.13 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.206 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.519 HG13 ' HE2' ' A' ' 121' ' ' LYS . 6.6 m -92.02 117.87 36.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.219 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -110.26 83.18 1.71 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.778 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.536 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.3 mt -90.35 166.58 13.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.034 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.463 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 24.0 ttp180 -131.28 105.9 7.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.793 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.799 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -56.67 170.13 0.42 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.271 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.76 -30.49 20.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.988 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -119.11 168.87 10.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.931 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -78.02 -57.37 3.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.872 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -58.77 -35.38 72.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.173 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 168' ' ' TRP . 16.8 p -61.33 -51.89 66.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.919 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.799 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -58.67 -39.03 79.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.191 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.21 -45.42 66.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.716 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 4.9 m -67.42 -32.58 73.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.007 0.432 . . . . 0.0 110.254 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.728 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 5.1 m95 -72.98 -47.86 41.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.828 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.535 ' HA ' HD12 ' A' ' 172' ' ' ILE . . . -56.79 -58.57 7.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.315 0.579 . . . . 0.0 110.164 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.31 -40.13 60.11 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.558 -0.747 . . . . 0.0 112.588 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.35 -41.02 81.31 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.791 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.735 HG21 HD13 ' A' ' 146' ' ' ILE . 10.8 mt -59.64 -24.0 27.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 177.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.657 ' N ' HG11 ' A' ' 130' ' ' VAL . 11.5 tt0 -77.39 -37.57 51.73 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.013 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 174' ' ' ALA . . . . . 0.417 ' HA ' ' CG2' ' A' ' 178' ' ' THR . . . -59.35 -47.68 84.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.538 179.544 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -37.29 77.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.063 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.479 HD12 HG22 ' A' ' 172' ' ' ILE . 49.3 mt -68.29 -29.15 43.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.039 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.535 ' O ' HG22 ' A' ' 178' ' ' THR . . . 152.02 -47.47 0.57 Allowed Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.398 -0.906 . . . . 0.0 112.936 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 178' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 177' ' ' GLY . 9.6 t . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.304 -0.855 . . . . 0.0 111.349 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.799 0.333 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.2 t 60.79 102.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.889 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 173.29 75.48 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.506 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -38.53 91.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.726 0.298 . . . . 0.0 110.887 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.98 88.3 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.775 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -125.71 138.94 32.93 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.209 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -73.6 153.17 49.1 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.591 2.194 . . . . 0.0 112.375 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -93.83 142.24 27.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.823 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.92 HG22 ' HA ' ' A' ' 33' ' ' SER . 38.1 p -140.77 161.61 37.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.943 0.402 . . . . 0.0 111.213 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.56 140.41 5.55 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.356 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 26.8 mt -61.14 120.72 10.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.927 0.394 . . . . 0.0 110.959 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.806 HD13 HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -132.78 154.94 49.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.743 179.915 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.54 160.25 20.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.905 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 46.1 tp -141.31 126.44 18.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.632 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.437 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 2.4 ttm180 -69.34 178.37 2.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.618 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -162.18 93.96 0.89 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.852 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -136.37 138.45 9.87 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.51 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -167.03 -171.38 1.77 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.774 0.321 . . . . 0.0 111.235 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.28 -136.04 19.62 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.577 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.1 m -60.99 -171.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.753 0.311 . . . . 0.0 110.987 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -97.0 29.4 10.71 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.542 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -79.52 170.9 15.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.765 0.317 . . . . 0.0 110.987 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -110.37 42.03 2.08 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.582 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -105.82 42.83 1.81 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.381 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -68.52 179.27 1.73 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.791 0.329 . . . . 0.0 111.032 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.33 -174.51 3.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.813 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.438 ' CH2' ' HB2' ' A' ' 158' ' ' ARG . 31.3 m95 -149.17 160.86 42.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.755 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.51 168.71 26.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.839 0.352 . . . . 0.0 111.068 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 -92.24 137.01 32.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.975 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 30' ' ' VAL . 29.3 m -156.44 120.77 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.021 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.2 tp -69.73 128.24 35.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.703 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.806 HD22 HD13 ' A' ' 12' ' ' LEU . 7.5 mp -92.98 139.73 30.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.99 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.92 ' HA ' HG22 ' A' ' 9' ' ' THR . 3.3 t -113.48 77.43 1.05 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.681 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.5 ' HA ' HD22 ' A' ' 39' ' ' LEU . 7.5 tp -72.99 96.25 2.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.86 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -96.29 148.09 23.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.905 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.26 -13.45 38.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.511 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -103.45 -19.03 14.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.391 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.703 ' HA ' HD13 ' A' ' 125' ' ' LEU . . . -176.2 174.42 2.02 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.968 0.413 . . . . 0.0 111.38 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.539 ' C ' HD13 ' A' ' 39' ' ' LEU . 3.0 tm? -112.94 93.94 4.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.67 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.8 m -98.99 134.74 41.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.94 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.636 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 13.1 t -106.27 158.59 6.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.98 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.449 ' N ' HG12 ' A' ' 41' ' ' VAL . 14.9 p -146.56 152.12 44.7 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.787 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.72 44.48 1.43 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.611 2.207 . . . . 0.0 112.688 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 48.17 28.82 1.64 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.097 0.475 . . . . 0.0 111.188 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -57.85 102.45 0.1 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.916 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 137.52 85.06 0.15 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.556 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.9 mp0 -92.28 147.6 34.87 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.705 0.288 . . . . 0.0 111.019 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.43 165.05 33.51 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.64 2.227 . . . . 0.0 112.214 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 62.26 115.91 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.447 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -51.31 99.7 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.477 2.118 . . . . 0.0 112.286 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -140.51 93.88 8.59 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.958 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -52.8 -173.64 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.541 2.161 . . . . 0.0 112.334 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.65 163.31 2.76 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.982 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -64.24 -175.58 0.33 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.533 2.155 . . . . 0.0 112.303 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.31 134.88 29.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.125 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.61 87.25 6.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.942 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 5.3 mt -80.4 -31.56 37.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.914 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -89.16 121.6 31.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.871 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -131.58 97.06 0.34 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.503 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -141.05 129.09 21.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.815 0.34 . . . . 0.0 111.141 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 59.83 93.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.038 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -55.12 107.39 0.86 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.06 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -60.51 132.18 42.01 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.424 2.083 . . . . 0.0 112.223 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.39 -44.33 7.49 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.376 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -120.49 179.61 4.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.76 0.314 . . . . 0.0 111.029 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -93.35 129.94 37.25 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.106 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -74.43 155.14 45.76 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.495 2.13 . . . . 0.0 112.337 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -53.11 -174.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.553 2.169 . . . . 0.0 112.224 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.8 160.16 17.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.909 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.48 152.51 57.71 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.917 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -51.72 114.32 1.54 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.602 2.201 . . . . 0.0 112.348 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -152.55 68.33 0.84 Allowed 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.984 0.897 . . . . 0.0 110.719 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 178.09 -60.38 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 113.865 -1.516 . . . . 0.0 109.878 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.569 HD21 ' HE1' ' A' ' 84' ' ' PHE . 1.4 tt -90.01 -21.42 22.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.949 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.847 HD22 ' O ' ' A' ' 75' ' ' LEU . 0.1 OUTLIER -85.87 -35.96 20.25 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.462 179.764 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.553 ' N ' HD13 ' A' ' 75' ' ' LEU . 1.5 tp -53.55 -27.43 26.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.221 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -57.53 -85.62 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.848 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.1 ttp85 74.15 -52.95 0.69 Allowed 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.08 56.2 0.32 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.986 0.422 . . . . 0.0 111.117 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 26.0 t -143.36 -45.21 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.869 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.443 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -139.48 123.31 10.92 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.748 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 81' ' ' SER . 15.3 Cg_exo -68.67 54.04 0.79 Allowed 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.669 2.246 . . . . 0.0 112.547 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.3 t80 176.18 39.13 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.742 0.306 . . . . 0.0 110.73 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.569 ' HE1' HD21 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -84.75 91.43 7.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.852 -179.87 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.4 ptpt -172.89 170.47 4.54 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.89 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -130.4 169.01 16.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.792 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.44 -42.37 4.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.871 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -87.82 155.2 20.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.106 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 160.15 80.28 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.461 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -131.41 -136.53 3.91 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.474 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.6 t -167.03 159.61 13.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.834 0.35 . . . . 0.0 110.881 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.5 m -82.74 114.82 21.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.478 HG22 ' N ' ' A' ' 94' ' ' GLY . 11.1 p -65.06 158.46 4.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.989 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.478 ' N ' HG22 ' A' ' 93' ' ' VAL . . . -76.88 -104.1 0.15 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.501 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -158.46 74.76 0.7 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.884 0.373 . . . . 0.0 110.946 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 59.51 37.25 22.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.984 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.1 t -102.24 93.49 3.96 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.932 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -68.37 111.16 2.44 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.569 2.179 . . . . 0.0 112.327 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.37 -27.43 7.88 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.484 2.122 . . . . 0.0 112.352 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -136.36 103.72 5.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.124 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 3.2 p -81.34 116.43 62.74 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.864 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.14 62.47 4.15 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.442 2.095 . . . . 0.0 112.239 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.637 HD12 ' N ' ' A' ' 104' ' ' GLN . 1.4 pp -151.48 -45.91 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.996 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.637 ' N ' HD12 ' A' ' 103' ' ' LEU . 1.1 mt-30 -88.32 -45.2 10.22 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.832 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.81 149.26 24.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.918 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -98.24 100.93 9.91 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.837 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -67.98 123.47 10.7 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.406 2.071 . . . . 0.0 112.278 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 2.5 t -171.67 92.68 0.14 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.87 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.3 m 61.12 91.72 0.07 OUTLIER Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -68.14 155.6 68.9 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.515 2.143 . . . . 0.0 112.325 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -106.9 102.17 1.82 Allowed Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.455 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -50.26 148.63 13.85 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.526 2.151 . . . . 0.0 112.411 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.6 pm0 -87.55 156.22 53.48 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.836 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.33 115.56 3.24 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.639 2.226 . . . . 0.0 112.177 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 58.8 mtp180 -147.06 42.85 1.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.894 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -147.39 -55.2 0.23 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.866 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -162.43 105.19 1.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.856 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.35 133.61 34.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.854 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 61.16 166.53 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.636 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -84.54 164.69 18.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.198 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.401 ' HE2' ' CG1' ' A' ' 155' ' ' VAL . 44.8 tttp -105.38 84.74 2.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.89 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 3.2 m80 -73.84 92.21 2.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.866 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.481 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 27.4 t -85.97 120.44 35.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.171 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 1.7 m -68.53 131.85 45.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.88 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.703 HD13 ' HA ' ' A' ' 38' ' ' ALA . 1.2 mp -87.88 -168.19 2.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.857 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.441 ' HG3' HG23 ' A' ' 178' ' ' THR . 0.0 OUTLIER 62.07 32.69 17.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.761 -179.844 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.641 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 3.2 mtt -171.04 -41.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.001 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.23 -169.69 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.138 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.467 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.3 OUTLIER -170.2 122.88 0.68 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.472 179.797 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.601 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.3 p -96.45 158.8 3.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.342 0.591 . . . . 0.0 111.539 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' HG22 ' A' ' 130' ' ' VAL . 15.8 m -151.93 166.4 31.61 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.645 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.2 ttp180 -134.04 85.8 2.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.062 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.58 -168.12 0.79 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.872 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 53.8 m -122.51 132.59 54.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.916 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.554 HG23 ' CE2' ' A' ' 143' ' ' TYR . 0.2 OUTLIER -95.06 136.76 22.48 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.023 -179.934 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -79.26 -27.2 4.53 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.585 2.19 . . . . 0.0 112.568 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 20.4 p -79.37 -34.8 41.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.271 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -130.59 97.69 21.19 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.883 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.58 61.81 8.07 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.591 2.194 . . . . 0.0 112.751 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.518 ' CB ' ' HD3' ' A' ' 141' ' ' PRO . 1.7 mt-10 -169.66 -60.48 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.033 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.518 ' HD3' ' CB ' ' A' ' 140' ' ' GLU . 50.7 Cg_exo -53.08 -29.78 46.67 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.281 1.987 . . . . 0.0 112.141 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 62.94 152.95 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.84 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.554 ' CE2' HG23 ' A' ' 135' ' ' THR . 0.1 OUTLIER -89.46 132.91 34.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.879 -179.857 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.653 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.4 OUTLIER -111.6 115.14 28.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.581 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -117.66 136.46 53.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.055 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.619 HD13 HG21 ' A' ' 172' ' ' ILE . 28.7 mt -135.94 104.24 4.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.978 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 29.7 m -90.1 136.42 33.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.957 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -114.65 150.8 34.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.041 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.641 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -94.06 30.92 1.76 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.5 -179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -110.67 42.81 1.52 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.035 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.68 25.71 2.54 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.118 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 56.75 59.42 3.54 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.035 0.445 . . . . 0.0 110.934 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -94.08 162.75 13.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.805 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.39 93.42 0.85 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.182 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.401 ' CG1' ' HE2' ' A' ' 121' ' ' LYS . 6.6 m -83.23 128.31 38.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.13 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.437 ' CE1' ' HB3' ' A' ' 15' ' ' ARG . 0.2 OUTLIER -109.12 93.11 4.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.751 -179.91 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.583 HD22 HD11 ' A' ' 32' ' ' LEU . 1.3 mp -96.71 167.52 11.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.077 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.438 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -130.75 112.81 13.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.811 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.883 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -67.56 172.13 5.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.14 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -85.59 -66.05 0.94 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.024 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -97.96 170.86 8.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.881 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.01 -47.44 58.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.032 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.25 -38.4 90.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.139 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 30.4 t -61.75 -47.66 84.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.868 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.883 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -60.47 -41.2 93.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.224 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 51.9 mtp180 -70.08 -44.06 69.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.543 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.3 -34.32 77.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.054 179.475 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.403 ' O ' HD12 ' A' ' 172' ' ' ILE . 11.2 m95 -74.26 -50.86 17.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.834 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.653 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -56.23 -51.58 67.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.399 0.619 . . . . 0.0 110.491 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.94 -40.81 95.82 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.798 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.21 -41.09 77.55 Favored 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.355 -179.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.717 HG22 HD12 ' A' ' 176' ' ' ILE . 6.8 mt -62.65 -23.18 31.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.601 ' N ' HG11 ' A' ' 130' ' ' VAL . 54.2 tt0 -80.66 -30.52 36.55 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.315 179.067 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.57 -47.34 76.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.338 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 175' ' ' GLN . . . . . 0.568 ' HB3' HD21 ' A' ' 125' ' ' LEU . 2.0 mp0 -70.55 -39.37 74.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.998 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.717 HD12 HG22 ' A' ' 172' ' ' ILE . 84.5 mt -78.11 -9.95 12.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.195 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -86.6 26.88 6.12 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.448 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 178' ' ' THR . . . . . 0.441 HG23 ' HG3' ' A' ' 126' ' ' LYS . 3.2 t . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.919 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.841 0.353 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.5 t -171.44 37.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.869 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -155.35 40.2 0.61 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.574 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 -101.82 -46.29 4.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.769 0.319 . . . . 0.0 110.871 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -81.99 169.15 17.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.891 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -134.68 95.96 15.37 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.98 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -67.65 154.8 72.38 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.513 2.142 . . . . 0.0 112.306 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.63 155.76 25.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.813 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.758 HG22 ' HA ' ' A' ' 33' ' ' SER . 74.6 p -144.35 138.12 27.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.968 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -136.72 121.62 2.41 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.435 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.548 HD22 ' HD3' ' A' ' 29' ' ' ARG . 31.0 mt -68.53 114.09 6.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.876 0.37 . . . . 0.0 110.921 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.455 HD22 ' HB2' ' A' ' 157' ' ' LEU . 0.2 OUTLIER -129.21 150.24 50.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.72 179.877 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -83.58 163.22 20.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.036 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 39.6 tp -130.95 126.63 36.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.636 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.473 ' HA ' ' CD2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.35 174.77 4.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.63 -179.837 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -165.16 59.12 0.12 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.954 0.406 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -141.51 30.98 2.17 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.532 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.11 108.62 18.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.875 0.369 . . . . 0.0 111.101 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 130.54 -98.12 0.4 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.507 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.3 p -168.08 161.4 12.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.795 0.331 . . . . 0.0 110.916 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.15 -49.18 0.9 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.474 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.57 125.72 27.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.929 0.395 . . . . 0.0 111.019 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -114.43 -28.0 3.17 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.605 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.18 15.63 60.15 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.75 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 57.0 104.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.788 0.328 . . . . 0.0 110.995 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.94 147.04 26.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.043 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.473 ' CD2' ' HA ' ' A' ' 15' ' ' ARG . 22.1 m95 -150.8 159.89 44.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.655 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -146.47 -175.02 4.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.994 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.548 ' HD3' HD22 ' A' ' 11' ' ' LEU . 0.3 OUTLIER -109.98 137.34 47.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 26.2 m -151.19 128.02 2.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.12 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.2 tp -81.98 127.23 32.85 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.424 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.468 HD12 HG13 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -94.16 92.78 7.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.104 -179.623 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.758 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.7 OUTLIER -73.15 89.22 1.49 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.579 179.462 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.711 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 4.6 tp -84.65 119.86 25.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.152 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -122.83 138.8 54.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.022 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -56.77 -23.2 41.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.462 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -89.55 -29.95 18.56 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.006 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.862 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -175.72 166.82 3.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.135 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.558 HD11 HG23 ' A' ' 172' ' ' ILE . 0.2 OUTLIER -103.56 152.93 21.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.752 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 88.3 m -158.21 132.64 8.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.772 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.635 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 14.7 t -117.86 159.26 18.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.214 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.483 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -155.31 176.27 2.64 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.539 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.412 ' HD2' ' CB ' ' A' ' 42' ' ' SER . 84.7 Cg_endo -82.25 38.52 0.75 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.531 2.154 . . . . 0.0 112.841 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 48.89 28.68 2.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.116 0.484 . . . . 0.0 111.07 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -136.91 114.34 10.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.819 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 138.43 58.16 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.391 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -89.21 147.9 39.49 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.729 0.299 . . . . 0.0 110.851 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.12 93.51 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.6 2.2 . . . . 0.0 112.266 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 129.54 101.22 0.96 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.57 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -49.09 172.1 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.497 2.132 . . . . 0.0 112.305 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.458 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -179.37 -61.19 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.029 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.458 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 18.7 Cg_endo -59.88 82.84 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.452 2.101 . . . . 0.0 112.277 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.4 ' CB ' ' HD2' ' A' ' 54' ' ' PRO . 2.4 mt-10 -77.62 165.49 50.92 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.786 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.4 ' HD2' ' CB ' ' A' ' 53' ' ' GLU . 12.8 Cg_endo -56.28 142.88 87.31 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.643 2.228 . . . . 0.0 112.16 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -134.51 -166.64 1.84 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.097 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 62.95 88.05 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.815 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.52 169.89 13.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.876 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.11 122.17 25.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.894 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 98.8 56.56 1.01 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.431 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -130.29 155.26 46.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.786 0.327 . . . . 0.0 111.074 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -100.86 158.98 15.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.06 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -97.99 143.75 26.8 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.939 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.16 113.92 1.57 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.561 2.174 . . . . 0.0 112.231 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -79.89 72.82 2.53 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.448 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -80.04 132.75 36.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.844 0.354 . . . . 0.0 111.115 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.829 ' HB3' ' HD3' ' A' ' 67' ' ' PRO . . . -72.26 -59.53 2.62 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.251 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.829 ' HD3' ' HB3' ' A' ' 66' ' ' ALA . 67.2 Cg_endo -75.21 154.6 41.62 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.932 2.422 . . . . 0.0 112.425 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.13 80.55 1.26 Allowed 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.545 2.164 . . . . 0.0 112.375 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -92.79 150.16 20.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.927 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 60.74 99.82 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.832 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.09 171.74 12.05 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.421 2.081 . . . . 0.0 112.275 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.549 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.3 mt-10 64.56 70.79 0.48 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.353 0.597 . . . . 0.0 110.75 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 166.3 -33.02 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.652 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.4 tt -103.71 -30.25 10.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.006 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.647 ' C ' HD22 ' A' ' 75' ' ' LEU . 0.0 OUTLIER -74.62 -5.52 43.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.585 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.465 ' N ' HD13 ' A' ' 75' ' ' LEU . 0.8 OUTLIER -84.49 -49.15 8.89 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.855 0.36 . . . . 0.0 110.71 179.998 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -98.06 69.97 2.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.774 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -86.81 -40.29 15.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.897 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -98.15 31.45 2.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 20.7 t -126.89 -39.62 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.24 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.454 ' N ' ' HD2' ' A' ' 82' ' ' PRO . 0.4 OUTLIER -51.18 -56.75 17.55 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.368 -179.945 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 81' ' ' SER . 67.3 Cg_endo -75.72 59.26 5.61 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 122.933 2.422 . . . . 0.0 112.429 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER 57.02 171.93 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.067 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -173.61 138.9 0.69 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.829 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.75 101.1 0.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.976 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 60.35 100.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.817 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -133.71 -65.85 0.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.89 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -169.38 148.51 3.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.027 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -90.19 -43.3 5.03 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.531 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -178.42 -168.06 37.19 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.433 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.7 163.19 28.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.898 0.38 . . . . 0.0 110.983 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -167.28 103.67 0.53 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.831 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.2 p -99.19 145.86 9.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.072 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 171.12 -90.19 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.474 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 15.8 t90 60.94 83.3 0.15 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.821 0.343 . . . . 0.0 110.841 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 3.2 t0 60.68 52.35 4.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.84 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.4 t -149.55 74.28 9.64 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.94 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -55.39 169.93 0.96 Allowed 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.517 2.144 . . . . 0.0 112.161 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -66.82 -17.22 51.83 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.497 2.132 . . . . 0.0 112.492 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -82.53 109.78 17.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.166 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -140.81 164.84 33.68 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.874 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.31 -179.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.598 2.198 . . . . 0.0 112.24 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.505 ' N ' HD12 ' A' ' 103' ' ' LEU . 1.4 mp -120.05 161.43 20.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.901 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -161.04 134.73 6.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.852 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -119.68 42.05 2.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.834 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -110.39 94.89 20.09 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.844 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -49.72 92.29 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.508 2.138 . . . . 0.0 112.44 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -143.94 137.89 28.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.922 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -149.4 169.28 9.42 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.798 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.89 151.67 15.24 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.562 2.174 . . . . 0.0 112.322 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -144.18 -178.42 19.88 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.546 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.41 98.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.569 2.18 . . . . 0.0 112.357 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -132.72 71.0 78.98 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.988 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.45 101.68 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.633 2.222 . . . . 0.0 112.312 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.75 119.08 36.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.816 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -152.1 -69.36 0.16 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.937 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.618 HD13 ' O ' ' A' ' 119' ' ' GLU . 4.2 pp -108.46 149.66 28.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.01 -33.01 7.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.883 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.618 ' O ' HD13 ' A' ' 117' ' ' LEU . 4.7 tt0 -88.91 142.95 27.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.967 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.635 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -86.08 166.16 16.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.103 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -101.4 97.72 8.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.88 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -88.94 113.94 25.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.961 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.788 HG13 ' HB2' ' A' ' 148' ' ' ALA . 21.7 t -103.18 137.92 29.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.085 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.646 ' C ' HD22 ' A' ' 125' ' ' LEU . 0.3 OUTLIER -76.27 159.79 30.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.868 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.862 HD23 ' HA ' ' A' ' 38' ' ' ALA . 4.2 mm? -123.6 34.36 5.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.974 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.29 34.84 1.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.964 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 3.3 ptp 178.55 -37.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.0 -177.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.324 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.415 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.2 OUTLIER -159.23 124.36 4.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.461 179.918 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.699 HG12 HD12 ' A' ' 176' ' ' ILE . 2.9 p -101.27 159.95 3.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.318 0.58 . . . . 0.0 111.497 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.519 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -161.45 156.13 23.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.994 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.65 139.72 53.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.772 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 -157.48 -173.0 4.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.793 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 3.8 p -118.24 176.26 5.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.022 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.45 HG23 ' HD3' ' A' ' 136' ' ' PRO . 0.1 OUTLIER -98.9 -52.51 0.2 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.303 -179.689 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 136' ' ' PRO . . . . . 0.45 ' HD3' HG23 ' A' ' 135' ' ' THR . 1.8 Cg_endo -84.95 12.49 3.06 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 123.015 2.477 . . . . 0.0 112.722 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' THR . . . . . 0.423 HG23 ' C ' ' A' ' 136' ' ' PRO . 1.4 p 68.16 30.35 5.79 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.933 0.397 . . . . 0.0 110.38 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 52.3 p-10 -108.43 146.66 34.1 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.03 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -63.02 78.25 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.531 2.154 . . . . 0.0 112.115 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -165.51 107.77 0.76 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.805 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.511 ' CB ' ' HB3' ' A' ' 165' ' ' ALA . 82.8 Cg_exo -47.59 98.23 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.56 2.173 . . . . 0.0 112.388 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 2.1 mtt85 -146.25 31.67 1.01 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.943 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -165.3 91.63 0.53 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.057 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.855 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 1.2 mt -94.23 116.14 28.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.753 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -108.98 130.29 55.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.87 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.445 HG12 HG23 ' A' ' 130' ' ' VAL . 35.6 mt -132.91 120.72 42.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.097 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 35.8 t -109.78 124.27 50.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.777 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.788 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -108.53 147.51 31.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.21 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.47 30.74 2.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.179 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -112.09 42.75 1.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.404 179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.68 25.28 2.17 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.955 -0.641 . . . . 0.0 112.359 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 58.56 60.55 2.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.068 0.461 . . . . 0.0 110.923 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.523 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 1.5 m-20 -93.31 148.38 22.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.861 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -155.64 90.41 1.24 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.092 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 27.2 m -88.94 131.2 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.21 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -118.0 96.29 5.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.68 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.455 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.7 OUTLIER -103.28 167.06 10.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.041 -179.712 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.455 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 69.2 ttt180 -132.8 101.16 5.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.719 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.517 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -58.85 173.49 0.43 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.158 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.06 -33.27 10.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.935 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.03 -170.01 1.78 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.822 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -108.21 -56.66 2.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.71 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.39 -29.91 70.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.872 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 3.4 m -65.25 -47.48 76.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.504 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.572 ' HA ' HD11 ' A' ' 144' ' ' LEU . . . -61.54 -46.05 91.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.026 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -69.64 -37.91 76.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.518 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 88.5 p -70.01 -34.21 73.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.167 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.711 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 6.9 m95 -73.06 -48.88 32.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.865 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.855 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -57.3 -51.82 67.82 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.359 0.599 . . . . 0.0 110.486 179.621 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.82 -40.87 93.62 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.748 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.96 76.39 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.049 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.564 HG22 ' CD1' ' A' ' 176' ' ' ILE . 9.5 mt -61.62 -22.83 29.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.539 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -71.11 -55.53 8.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.477 179.239 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 174' ' ' ALA . . . . . 0.713 ' HA ' HG22 ' A' ' 178' ' ' THR . . . -52.73 -37.74 59.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.119 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.43 -30.46 57.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.311 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.699 HD12 HG12 ' A' ' 130' ' ' VAL . 19.4 mt -71.33 -25.91 25.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.913 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 111.13 37.35 1.67 Allowed Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.788 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 178' ' ' THR . . . . . 0.713 HG22 ' HA ' ' A' ' 174' ' ' ALA . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.902 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.821 0.343 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.6 t -130.09 166.43 20.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.815 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -156.83 124.81 1.49 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.515 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.02 178.99 5.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.826 0.346 . . . . 0.0 110.85 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 10.9 mmt-85 -70.62 155.05 41.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.017 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -104.69 88.92 2.46 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.099 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -68.74 152.21 74.23 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.502 2.135 . . . . 0.0 112.452 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.536 ' NH2' ' HB1' ' A' ' 171' ' ' ALA . 34.3 ttp180 -97.56 143.42 28.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.977 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.0 p -141.44 154.6 45.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.938 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -159.6 135.79 4.3 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.535 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.506 HD22 ' HB1' ' A' ' 44' ' ' ALA . 66.4 mt -66.56 105.3 1.47 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.806 0.336 . . . . 0.0 110.989 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.575 HD13 HD22 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -116.26 152.34 34.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.819 179.92 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.425 ' HB3' ' CE3' ' A' ' 27' ' ' TRP . 4.5 tt0 -78.93 170.11 17.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.878 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.407 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 39.7 tp -145.33 120.81 10.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.74 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.467 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.2 OUTLIER -69.49 157.6 36.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.453 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -169.71 79.7 0.11 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.023 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -175.49 33.4 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.624 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 54.12 99.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.834 0.349 . . . . 0.0 111.227 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.01 87.87 0.38 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.659 -0.782 . . . . 0.0 112.556 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.1 m -112.72 -65.2 1.21 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.828 0.347 . . . . 0.0 110.95 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -174.19 -53.13 0.05 OUTLIER Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.455 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -151.16 129.24 11.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.802 0.334 . . . . 0.0 111.149 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -177.87 -68.47 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.459 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 163.42 74.12 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.428 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.33 131.92 52.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.784 0.326 . . . . 0.0 110.808 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 mtm180 -113.68 68.91 0.69 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.921 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.467 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 21.7 m95 -56.69 -178.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.776 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.56 175.88 5.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.88 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -105.62 127.03 52.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.958 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.4 m -141.46 130.26 23.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.109 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.7 tp -73.5 124.9 26.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.751 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.82 HD12 HG13 ' A' ' 41' ' ' VAL . 1.9 tp -92.39 125.38 37.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.972 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.14 87.89 3.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.78 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.728 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 4.8 tp -84.09 123.14 29.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.015 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -134.28 139.77 45.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.016 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.36 -23.53 49.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.103 0.478 . . . . 0.0 111.278 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -83.77 -31.17 26.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.89 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.685 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -174.62 169.1 3.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.262 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.521 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -112.76 106.58 14.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.723 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 28.0 m -115.7 132.04 56.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.997 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.82 HG13 HD12 ' A' ' 32' ' ' LEU . 17.6 t -106.24 160.15 5.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.921 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.479 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -165.44 167.17 9.62 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.764 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.63 148.45 65.93 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.571 2.181 . . . . 0.0 112.267 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.506 ' HB1' HD22 ' A' ' 11' ' ' LEU . . . -96.4 43.3 1.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.004 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -149.71 31.64 0.71 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.949 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 94.77 -160.88 23.52 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.638 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -112.53 161.67 25.22 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.694 0.283 . . . . 0.0 110.9 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -50.15 178.54 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.759 2.306 . . . . 0.0 112.234 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -105.05 90.81 0.72 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.633 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.76 -170.95 0.67 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.665 2.243 . . . . 0.0 112.179 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 58.72 88.74 0.12 Allowed Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.989 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -51.49 117.83 3.83 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.537 2.158 . . . . 0.0 112.395 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -98.71 98.59 6.3 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.864 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -67.86 84.64 0.41 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.4 2.067 . . . . 0.0 112.323 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.747 ' HB1' ' O ' ' A' ' 109' ' ' SER . . . -79.8 158.59 26.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.016 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -105.43 175.59 5.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.92 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.451 HD12 ' H ' ' A' ' 57' ' ' LEU . 3.6 mp -90.54 166.08 13.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.919 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -143.69 85.21 1.82 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.98 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 121.23 125.57 3.2 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.425 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -112.63 150.6 31.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.821 0.343 . . . . 0.0 111.066 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 60.59 169.5 0.09 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.06 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 54.96 67.66 3.07 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.945 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.47 -173.44 0.02 OUTLIER 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.504 2.136 . . . . 0.0 112.238 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.95 -63.76 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.563 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -121.79 95.04 4.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.788 0.328 . . . . 0.0 111.103 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.814 ' HB3' ' HD3' ' A' ' 67' ' ' PRO . . . -73.21 -59.53 2.07 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.261 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.814 ' HD3' ' HB3' ' A' ' 66' ' ' ALA . 72.2 Cg_endo -75.91 162.52 34.69 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 123.002 2.468 . . . . 0.0 112.504 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -56.7 -163.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.666 2.244 . . . . 0.0 112.284 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -88.1 -176.27 5.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.919 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.1 mp -128.45 108.52 19.19 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.016 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.537 ' HB2' HD21 ' A' ' 75' ' ' LEU . 56.9 Cg_endo -70.38 -165.78 0.18 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.509 2.139 . . . . 0.0 112.248 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.712 ' HA ' HD11 ' A' ' 75' ' ' LEU . 2.3 mt-10 68.79 73.55 0.27 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.382 0.61 . . . . 0.0 110.714 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.571 ' C ' HD12 ' A' ' 74' ' ' LEU . . . 170.26 -37.89 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.552 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.571 HD12 ' C ' ' A' ' 73' ' ' ALA . 5.9 mp -112.23 -17.66 12.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.171 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.712 HD11 ' HA ' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -95.47 -15.01 23.24 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.617 -179.862 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.764 HD22 ' O ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -98.39 0.1 44.7 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.755 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.437 ' N ' HD13 ' A' ' 76' ' ' LEU . 18.4 pt20 -146.93 45.25 1.18 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.827 0.346 . . . . 0.0 111.087 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.17 -35.34 2.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.268 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -111.64 40.6 2.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.933 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 25.9 t -126.1 -48.36 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.148 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.4 m -64.69 162.91 31.82 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.841 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -79.17 49.94 3.33 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.101 2.534 . . . . 0.0 112.558 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 175.7 76.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.904 0.383 . . . . 0.0 110.589 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -109.11 150.73 27.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.908 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 168.29 1.29 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.998 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 16.9 p-10 -173.82 100.64 0.11 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.963 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -89.94 85.78 6.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.883 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -149.39 135.36 18.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.086 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 105.52 110.5 3.51 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.506 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -71.42 -81.72 0.29 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.614 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.98 146.79 37.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.868 0.366 . . . . 0.0 110.943 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -149.31 103.26 3.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.828 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.65 151.44 10.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.065 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 121.97 34.08 0.87 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.635 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 55.79 85.51 0.07 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.779 0.323 . . . . 0.0 111.013 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -170.4 45.39 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.809 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.3 t -129.7 80.51 71.48 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.871 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_exo -52.01 118.17 4.27 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.575 2.184 . . . . 0.0 112.232 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.65 -25.8 40.08 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.325 2.017 . . . . 0.0 112.321 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.22 147.26 36.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.096 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 95.9 p -121.35 92.35 48.57 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.888 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -50.43 102.88 0.06 OUTLIER 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.649 2.232 . . . . 0.0 112.35 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.2 mt 59.84 -179.08 0.09 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.914 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -164.24 79.76 0.39 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.785 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 57.2 mtt180 -139.59 148.89 43.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.922 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.427 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 0.0 OUTLIER -71.11 -61.62 2.21 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.131 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' A' ' 106' ' ' GLN . 35.8 Cg_endo -65.21 154.24 74.46 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.454 2.103 . . . . 0.0 112.385 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 64.4 p -121.62 149.72 42.76 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.838 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.747 ' O ' ' HB1' ' A' ' 55' ' ' ALA . 0.4 OUTLIER -74.28 -59.02 1.77 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.186 -179.994 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.411 ' HD3' ' CB ' ' A' ' 109' ' ' SER . 70.1 Cg_endo -75.93 163.56 33.1 Favored 'Trans proline' 0 N--CA 1.465 -0.177 0 C-N-CA 122.819 2.346 . . . . 0.0 112.493 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -161.18 62.66 0.28 Allowed Glycine 0 CA--C 1.519 0.297 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.449 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.01 147.15 27.25 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.538 2.158 . . . . 0.0 112.46 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -135.82 60.22 34.42 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.875 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.03 64.63 2.56 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.448 2.099 . . . . 0.0 112.341 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 mtt180 -76.34 157.01 32.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.846 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -170.84 -56.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.869 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 24.9 tp -139.98 62.98 1.49 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.826 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 74.6 m -65.46 -33.46 76.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.917 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -95.93 139.88 31.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.892 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.79 -170.14 0.4 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.085 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.06 78.03 1.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.861 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 21.0 m80 -71.46 146.75 48.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.057 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.4 t -149.45 113.29 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.067 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.18 147.73 52.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.064 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' A' ' 176' ' ' ILE . 3.0 mm? -98.31 -176.95 3.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.741 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 67.62 45.41 1.5 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.989 0.423 . . . . 0.0 110.95 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.578 ' HG2' ' HB3' ' A' ' 149' ' ' ALA . 0.2 OUTLIER 178.45 -37.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.768 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.696 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -68.09 -176.57 0.72 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.173 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.473 ' HA ' HG21 ' A' ' 176' ' ' ILE . 53.3 p90 -162.23 115.15 1.74 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.807 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.563 HG11 ' N ' ' A' ' 173' ' ' GLN . 1.6 p -78.78 158.92 4.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.274 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.473 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.9 OUTLIER -164.59 119.04 1.38 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.672 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 17.0 ptt-85 -94.05 86.35 4.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.866 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 10.0 mtt85 -69.92 178.12 2.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.869 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 19.0 p -127.63 153.38 46.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.935 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.41 HG23 ' CD1' ' A' ' 143' ' ' TYR . 13.3 p -104.41 158.21 32.45 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.829 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 136' ' ' PRO . . . . . 0.409 ' HD2' ' HB ' ' A' ' 135' ' ' THR . 36.3 Cg_endo -65.42 -17.53 57.9 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.506 2.138 . . . . 0.0 112.446 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.57 32.82 4.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.045 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -57.62 109.33 1.7 Allowed Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.022 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -78.89 -22.2 9.0 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.454 2.102 . . . . 0.0 112.544 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.401 ' N ' ' CD ' ' A' ' 141' ' ' PRO . 0.3 OUTLIER -179.62 -52.48 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.198 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.107 179.875 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' A' ' 140' ' ' GLU . 45.3 Cg_exo -56.65 -164.57 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.462 2.108 . . . . 0.0 112.237 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.56 140.32 18.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.969 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.41 ' CD1' HG23 ' A' ' 135' ' ' THR . 0.1 OUTLIER -62.05 98.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.758 179.965 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.658 HD12 ' HB2' ' A' ' 159' ' ' ALA . 2.3 mt -84.94 86.15 7.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.638 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.41 131.41 53.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.902 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.868 HD13 HG21 ' A' ' 172' ' ' ILE . 28.8 mt -126.87 137.38 58.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.082 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.696 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 0.8 OUTLIER -107.17 158.9 16.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.83 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.917 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -136.86 144.07 43.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.204 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.578 ' HB3' ' HG2' ' A' ' 127' ' ' MET . . . -95.73 31.16 2.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.234 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -116.44 44.88 1.9 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.457 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.74 23.22 3.12 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.432 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 59.62 62.0 1.84 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.034 0.445 . . . . 0.0 110.798 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.917 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 5.0 m-20 -94.76 156.42 16.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.814 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.82 93.64 0.82 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.152 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.2 m -83.19 130.13 36.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.162 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -106.56 89.56 3.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.837 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.3 mt -105.39 155.98 18.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.046 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.439 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 13.6 ttm180 -127.01 112.37 15.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.792 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.852 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -57.88 173.51 0.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.124 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.91 -31.11 11.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.99 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.92 -179.59 3.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -87.63 -59.16 2.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.875 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -62.24 -33.25 74.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.128 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.89 -44.86 84.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.753 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.852 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -64.37 -43.56 94.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.022 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.78 -41.07 75.61 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.158 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 60.5 p -65.32 -40.67 94.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.728 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 8.7 m95 -66.52 -55.59 14.83 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.505 179.296 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.47 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -46.02 -64.99 0.61 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.19 0.519 . . . . 0.0 110.897 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -49.7 -36.77 26.13 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.105 179.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 171' ' ' ALA . . . . . 0.536 ' HB1' ' NH2' ' A' ' 8' ' ' ARG . . . -69.0 -40.35 78.77 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.968 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.868 HG21 HD13 ' A' ' 146' ' ' ILE . 30.6 mm -59.68 -24.28 28.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 177.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.563 ' N ' HG11 ' A' ' 130' ' ' VAL . 2.7 tt0 -75.71 -44.64 40.98 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.779 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 174' ' ' ALA . . . . . 0.743 ' HA ' HG22 ' A' ' 178' ' ' THR . . . -56.76 -48.69 77.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.169 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -71.21 -32.06 68.36 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.067 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.721 ' HA ' HD12 ' A' ' 125' ' ' LEU . 7.0 mt -66.04 -28.85 44.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.619 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 116.18 43.25 0.67 Allowed Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.632 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 178' ' ' THR . . . . . 0.743 HG22 ' HA ' ' A' ' 174' ' ' ALA . 1.7 t . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.259 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.791 0.329 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.2 m -168.42 145.06 3.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.918 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -165.03 172.96 40.84 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.487 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.2 ttt-85 -116.22 91.27 3.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.865 0.364 . . . . 0.0 110.936 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.91 94.29 0.26 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.819 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -147.38 99.36 3.89 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.033 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -56.71 149.24 60.54 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.519 2.146 . . . . 0.0 112.395 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.96 121.31 42.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.423 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.42 HG22 ' HA ' ' A' ' 33' ' ' SER . 9.0 p -132.25 139.56 48.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.014 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.82 143.35 12.15 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.485 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' A' ' 11' ' ' LEU . 6.7 mt -69.52 106.98 3.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.764 0.316 . . . . 0.0 110.891 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.044 HD21 HD12 ' A' ' 144' ' ' LEU . 0.2 OUTLIER -121.95 144.22 49.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.649 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.431 ' O ' HD23 ' A' ' 157' ' ' LEU . 18.4 mt-10 -84.02 155.82 22.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.948 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tp -136.09 137.78 41.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.664 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.492 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.61 -164.88 0.07 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.679 -179.814 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -174.59 40.86 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.91 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.13 107.04 2.07 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.53 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -88.48 120.22 29.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.822 0.344 . . . . 0.0 111.12 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 105.35 -174.83 21.5 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.56 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.14 131.05 42.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.791 0.329 . . . . 0.0 110.926 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 62.66 -164.39 26.35 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.409 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.95 97.08 8.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.847 0.356 . . . . 0.0 111.108 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -122.5 69.61 0.43 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.396 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.33 62.74 2.51 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.493 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.9 159.06 30.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.831 0.348 . . . . 0.0 110.98 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.9 mtm180 -135.69 77.74 1.68 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.804 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.492 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 26.9 m95 -53.33 111.59 0.73 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.139 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.52 ' HG3' HD11 ' A' ' 70' ' ' LEU . 1.8 tt0 -108.6 146.86 32.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.806 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.7 ttt85 -72.9 136.07 45.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.008 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 42' ' ' SER . 35.1 m -141.17 169.95 14.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.109 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 tp -120.63 117.25 27.05 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.641 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.632 ' HG ' HG22 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -87.93 110.49 20.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.947 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.42 ' HA ' HG22 ' A' ' 9' ' ' THR . 7.8 t -89.85 79.86 6.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.666 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.99 HD12 HD23 ' A' ' 39' ' ' LEU . 1.1 tp -77.11 99.83 5.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.046 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.68 147.54 27.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.935 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -61.9 -16.22 48.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.444 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.49 -27.28 18.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.861 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.869 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -176.78 -179.74 1.0 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.974 0.416 . . . . 0.0 111.255 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.99 HD23 HD12 ' A' ' 34' ' ' LEU . 3.1 tm? -117.29 114.29 23.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.859 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 58.4 m -127.72 134.77 49.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.986 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.632 HG22 ' HG ' ' A' ' 32' ' ' LEU . 14.6 t -111.7 159.01 11.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.3 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.482 ' N ' HG12 ' A' ' 41' ' ' VAL . 9.9 p -148.04 160.64 37.05 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.372 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.447 ' HD3' HD23 ' A' ' 117' ' ' LEU . 72.2 Cg_endo -77.11 47.43 2.23 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.496 2.131 . . . . 0.0 112.871 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 43.68 30.39 0.36 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.018 0.437 . . . . 0.0 111.549 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.9 121.45 15.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.924 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -84.54 -91.78 0.77 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.461 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -72.78 111.13 10.06 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.485 0.184 . . . . 0.0 110.841 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -68.78 102.19 0.85 Allowed 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.43 2.087 . . . . 0.0 112.273 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.01 69.23 0.81 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.423 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.26 105.41 1.56 Allowed 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.678 2.252 . . . . 0.0 112.252 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.427 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 0.1 OUTLIER -72.3 -56.71 4.04 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.966 179.92 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 72.2 Cg_endo -75.03 160.84 39.59 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.531 2.154 . . . . 0.0 112.293 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.414 ' OE1' ' HB2' ' A' ' 55' ' ' ALA . 0.2 OUTLIER -109.04 151.86 42.16 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.003 -179.989 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.91 115.48 4.27 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.541 2.161 . . . . 0.0 112.203 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.414 ' HB2' ' OE1' ' A' ' 53' ' ' GLU . . . -149.94 163.88 36.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.169 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -25.71 39.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.995 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -95.75 21.83 7.99 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.172 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -95.67 -31.29 13.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.769 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.12 165.31 35.75 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.518 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -83.07 155.57 23.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.857 0.361 . . . . 0.0 111.078 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -164.71 108.38 0.9 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.17 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.88 84.43 0.2 Allowed Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.984 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.42 138.62 56.51 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.571 2.18 . . . . 0.0 112.368 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 132.27 138.78 4.19 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.563 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 59.73 93.1 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.827 0.346 . . . . 0.0 111.189 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.92 156.17 27.4 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.073 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.01 146.2 30.53 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.635 2.224 . . . . 0.0 112.29 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.85 62.62 3.14 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.381 2.054 . . . . 0.0 112.378 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -87.26 137.76 32.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.89 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.52 HD11 ' HG3' ' A' ' 28' ' ' GLN . 0.6 OUTLIER -110.42 88.57 7.63 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.859 179.981 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.9 -178.03 1.85 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.537 2.158 . . . . 0.0 112.349 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.549 ' HA ' HD11 ' A' ' 75' ' ' LEU . 2.4 mt-10 65.18 71.48 0.45 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.414 0.625 . . . . 0.0 110.712 -179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.52 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 169.51 -48.43 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.603 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -90.42 -32.4 16.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.61 179.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.679 HD12 ' N ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -67.72 -14.11 62.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.424 179.923 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.679 ' N ' HD12 ' A' ' 75' ' ' LEU . 0.9 OUTLIER -89.2 -42.69 11.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.867 0.365 . . . . 0.0 110.894 -179.97 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -72.77 84.97 1.21 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.951 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.55 -48.27 0.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.821 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.437 ' HB2' ' CD1' ' A' ' 84' ' ' PHE . 2.4 pt-20 -112.15 31.82 5.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.885 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.2 t -141.27 -47.06 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.224 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.417 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.4 OUTLIER -66.92 -54.58 20.26 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.182 179.994 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 81' ' ' SER . 86.9 Cg_endo -82.96 47.55 2.47 Favored 'Trans proline' 0 N--CA 1.464 -0.214 0 C-N-CA 123.123 2.549 . . . . 0.0 112.638 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 60.87 152.76 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.049 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.437 ' CD1' ' HB2' ' A' ' 79' ' ' GLU . 4.9 t80 -178.45 77.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.841 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.18 161.42 27.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.908 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -141.6 168.34 20.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.884 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.7 m -128.72 153.52 47.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -78.22 145.01 35.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.142 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.48 147.04 4.79 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.483 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 156.18 43.83 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.559 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.0 p -69.34 77.91 0.38 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.815 0.341 . . . . 0.0 111.015 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.37 21.68 5.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.113 0.482 . . . . 0.0 111.239 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.0 p -59.71 128.31 20.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.094 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 167.6 42.62 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.497 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -151.79 75.03 1.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.847 0.356 . . . . 0.0 110.894 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -108.92 39.62 1.99 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.972 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -153.21 90.42 3.5 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.886 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -68.5 111.07 2.44 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.647 2.231 . . . . 0.0 112.295 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -78.92 -27.66 4.52 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.437 2.091 . . . . 0.0 112.47 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -103.81 176.28 5.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.249 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 8.7 t -167.58 78.41 0.92 Allowed Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.667 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -68.78 173.15 10.49 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.648 2.232 . . . . 0.0 112.41 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.2 mp -94.93 -23.04 17.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.084 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 67.83 157.37 0.13 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.892 0.377 . . . . 0.0 110.937 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 58.6 mtt-85 -90.18 162.18 15.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.963 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.26 77.35 0.4 Allowed Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.905 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.91 -45.25 1.01 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.481 2.121 . . . . 0.0 112.32 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.69 -68.43 0.38 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.9 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.32 159.62 0.11 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.952 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -69.29 139.81 42.82 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.622 2.214 . . . . 0.0 112.294 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -145.62 -155.24 6.41 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.508 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.26 151.1 18.11 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.574 2.183 . . . . 0.0 112.309 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.17 120.59 71.46 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.801 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.37 130.06 36.64 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.437 2.091 . . . . 0.0 112.358 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 14.6 mtt180 -163.31 33.93 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.889 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -79.74 140.75 36.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.891 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.447 HD23 ' HD3' ' A' ' 43' ' ' PRO . 15.7 tp 67.79 -69.63 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.924 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 67.27 -71.71 0.1 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.006 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.25 135.18 54.1 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.831 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.66 157.16 32.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.131 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 17.1 mttm -101.8 90.66 4.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.928 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 29.0 m-70 -84.98 138.91 32.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 19.2 t -138.45 116.88 13.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.074 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 92.5 p -70.8 125.15 26.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.905 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.869 HD23 ' HA ' ' A' ' 38' ' ' ALA . 4.1 mm? -66.52 -179.48 0.84 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.917 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 60.48 35.77 20.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.859 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.41 ' SD ' ' HB3' ' A' ' 149' ' ' ALA . 2.5 mmt -164.74 -44.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.89 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.64 -165.54 0.06 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.256 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.648 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.1 OUTLIER -169.86 127.07 0.87 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.503 179.92 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.585 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.5 p -99.84 158.88 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.361 0.6 . . . . 0.0 111.646 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.481 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -166.5 133.0 2.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.677 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.444 ' HD3' ' HB3' ' A' ' 169' ' ' ALA . 39.4 ptt85 -102.96 96.05 6.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.846 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -114.48 176.79 4.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.914 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' CYS . . . . . 0.422 ' C ' HG22 ' A' ' 135' ' ' THR . 23.3 p -113.83 -164.34 0.92 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.762 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.574 HG23 ' CD ' ' A' ' 136' ' ' PRO . 0.5 OUTLIER -164.38 -62.44 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.013 179.784 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 136' ' ' PRO . . . . . 0.574 ' CD ' HG23 ' A' ' 135' ' ' THR . 20.4 Cg_endo -62.68 -72.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.127 1.885 . . . . 0.0 112.265 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 7.6 t -159.56 28.32 0.19 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.904 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 27.5 t70 51.4 65.6 6.34 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.163 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.77 -60.78 0.22 Allowed 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.464 2.11 . . . . 0.0 112.241 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.424 ' CB ' ' HD3' ' A' ' 141' ' ' PRO . 0.5 OUTLIER 177.49 -53.18 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.957 179.925 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.424 ' HD3' ' CB ' ' A' ' 140' ' ' GLU . 45.0 Cg_exo -56.65 -27.04 68.23 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.493 2.128 . . . . 0.0 112.318 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.8 mtt85 61.41 163.63 0.08 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.948 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.452 ' CZ ' ' CD ' ' A' ' 158' ' ' ARG . 15.0 m-85 -110.28 123.05 49.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.904 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 1.044 HD12 HD21 ' A' ' 12' ' ' LEU . 80.8 mt -83.58 132.63 34.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.777 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -133.68 125.36 28.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.789 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.493 HD11 HD13 ' A' ' 172' ' ' ILE . 22.8 mt -130.46 117.99 41.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.187 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 35.5 m -100.3 143.55 30.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.829 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.817 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -112.77 149.01 33.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.308 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.41 ' HB3' ' SD ' ' A' ' 127' ' ' MET . . . -95.92 30.58 2.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.255 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -120.98 48.15 1.69 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.074 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.35 19.11 3.58 Favored Glycine 0 N--CA 1.451 -0.332 0 CA-C-N 115.615 -0.72 . . . . 0.0 112.173 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 5.2 mm100 58.45 61.14 2.34 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 121.123 0.487 . . . . 0.0 111.063 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.817 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.9 m-20 -87.6 161.97 17.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.835 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.61 93.7 0.84 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.1 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.0 m -85.71 124.57 40.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.029 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -105.98 106.06 16.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.765 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.431 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.8 mt -113.76 164.6 13.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.076 -179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.452 ' CD ' ' CZ ' ' A' ' 143' ' ' TYR . 1.3 tpt180 -130.96 97.29 4.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.694 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.817 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.52 174.15 0.11 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.413 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -88.85 -67.21 0.85 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.003 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.39 173.84 7.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.105 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.52 -34.01 25.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.923 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -74.2 -46.33 42.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.936 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.5 -39.97 95.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.651 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.817 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -66.69 -42.34 86.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.997 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.7 mtt180 -70.7 -40.68 72.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.55 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 41.9 p -67.98 -33.05 73.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.145 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.596 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.7 m95 -73.0 -50.86 20.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.875 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.737 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -56.45 -50.06 72.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.306 0.574 . . . . 0.0 110.467 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.26 -42.2 95.32 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.647 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.04 -40.53 78.54 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.964 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.756 HG22 HD12 ' A' ' 176' ' ' ILE . 31.8 mt -60.89 -24.51 32.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.585 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.1 OUTLIER -81.77 -28.78 33.09 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.219 179.161 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.76 -50.54 66.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.128 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -67.29 -41.54 85.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.856 178.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.756 HD12 HG22 ' A' ' 172' ' ' ILE . 83.1 mt -77.39 -5.59 7.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.224 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -86.55 25.56 7.18 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.541 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 5.4 t . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.889 -179.984 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.736 0.303 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.3 m -144.4 -177.43 5.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.903 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 156.98 -78.84 0.19 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.459 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.44 28.93 18.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.701 0.286 . . . . 0.0 110.949 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.93 130.47 55.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.948 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -160.26 139.05 7.74 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.045 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -68.86 141.26 48.5 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.52 2.146 . . . . 0.0 112.36 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.764 ' HB3' HD23 ' A' ' 34' ' ' LEU . 5.4 ttm105 -70.59 133.98 47.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.874 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.462 HG22 ' HA ' ' A' ' 33' ' ' SER . 75.2 p -135.17 138.86 44.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.005 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.51 126.88 2.9 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.38 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.623 HD13 HH11 ' A' ' 29' ' ' ARG . 64.4 mt -68.85 99.38 1.03 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.823 0.344 . . . . 0.0 110.937 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.607 HD22 ' CB ' ' A' ' 157' ' ' LEU . 0.2 OUTLIER -106.03 151.17 24.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.788 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -88.35 134.79 33.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.513 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 20.6 tp -108.39 139.17 43.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.495 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.539 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.46 -167.22 0.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.746 0.307 . . . . 0.0 110.918 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -170.93 82.33 0.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.895 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -149.53 -109.95 0.52 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.528 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 60.38 31.62 20.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.74 0.305 . . . . 0.0 111.137 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -95.64 -106.91 2.19 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.516 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.32 -55.2 2.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.81 0.338 . . . . 0.0 110.934 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -145.71 165.93 27.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.422 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.01 116.49 14.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.845 0.355 . . . . 0.0 111.134 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 173.07 79.8 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.434 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.53 69.43 0.66 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.44 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -88.57 158.93 18.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.391 . . . . 0.0 110.942 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -123.14 60.44 1.05 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.722 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.539 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 33.5 m95 -57.56 98.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.075 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -89.65 -176.69 5.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.686 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.623 HH11 HD13 ' A' ' 11' ' ' LEU . 0.7 OUTLIER -106.41 130.08 54.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.851 0.358 . . . . 0.0 110.911 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 33.8 m -137.11 134.14 47.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.264 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 10.5 tp -78.86 128.12 32.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.7 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.658 HD12 HG13 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -99.38 123.6 43.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.045 -179.907 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.462 ' HA ' HG22 ' A' ' 9' ' ' THR . 1.1 t -97.51 89.87 4.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.708 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.774 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 2.5 tp -93.56 95.11 9.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.04 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.46 153.11 22.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.915 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -64.44 -14.04 54.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.409 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -96.13 -21.94 17.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.094 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.777 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -178.15 174.2 1.38 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.844 0.354 . . . . 0.0 111.134 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.601 HD13 HD12 ' A' ' 34' ' ' LEU . 21.6 tp -131.21 97.5 4.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.773 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 51.8 m -111.53 137.44 49.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.946 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.658 HG13 HD12 ' A' ' 32' ' ' LEU . 15.6 t -100.25 159.55 3.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.047 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.482 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -170.05 149.71 3.43 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.814 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.652 ' HD3' HD12 ' A' ' 117' ' ' LEU . 52.1 Cg_exo -52.89 153.06 16.0 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.511 2.141 . . . . 0.0 112.13 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -93.05 49.34 1.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.122 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -141.91 155.93 45.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.953 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 153.77 48.34 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.499 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.87 114.36 61.78 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.502 0.192 . . . . 0.0 110.945 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -72.32 173.74 12.61 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.387 2.058 . . . . 0.0 112.325 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 165.25 -102.13 0.19 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.554 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -74.68 112.1 3.47 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.555 2.17 . . . . 0.0 112.345 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.454 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 1.0 OUTLIER -78.34 -48.39 1.92 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.399 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 96.5 Cg_endo -79.74 118.01 3.74 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.293 1.995 . . . . 0.0 112.436 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -106.68 100.53 31.41 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.943 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.8 179.04 2.91 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.424 2.083 . . . . 0.0 112.301 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -77.18 172.89 12.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.099 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -107.58 -74.87 0.64 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.888 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 61.4 31.74 19.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.803 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -157.58 137.5 12.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -129.77 28.68 3.91 Favored Glycine 0 C--N 1.331 0.258 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.448 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.17 172.54 8.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.69 0.281 . . . . 0.0 111.126 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -148.55 125.33 11.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.042 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -90.04 133.32 33.88 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.888 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.08 170.93 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.429 2.086 . . . . 0.0 112.258 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -177.9 50.08 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.563 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 59.68 38.01 22.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.784 0.326 . . . . 0.0 111.08 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 60.99 66.2 1.76 Allowed Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.046 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.82 170.6 17.45 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.536 2.157 . . . . 0.0 112.367 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.52 129.57 17.0 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.524 2.149 . . . . 0.0 112.297 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -109.85 154.04 23.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.954 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -83.57 114.61 54.69 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.886 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.66 -175.46 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.42 2.08 . . . . 0.0 112.362 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.3 mt-10 64.06 70.55 0.5 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.422 0.63 . . . . 0.0 110.647 -179.799 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 167.36 -44.92 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.563 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.9 mp -94.34 -37.18 11.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.742 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.689 HD12 ' N ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -65.62 -15.15 62.47 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.409 179.978 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.689 ' N ' HD12 ' A' ' 75' ' ' LEU . 0.3 OUTLIER -82.07 -28.96 32.09 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.859 179.966 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -138.94 97.5 3.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.858 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.92 -23.98 14.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.182 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -96.34 31.57 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.194 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.531 ' O ' HG12 ' A' ' 80' ' ' VAL . 37.7 t -124.19 -3.67 6.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.661 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.478 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -76.78 -50.03 2.54 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-O 120.938 0.399 . . . . 0.0 111.119 179.974 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 81' ' ' SER . 47.5 Cg_endo -93.6 -141.57 0.02 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 123.615 2.877 . . . . 0.0 111.521 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -100.79 86.61 3.13 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.818 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -152.3 130.98 12.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.83 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -155.73 -176.1 5.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.896 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -133.75 -49.28 0.82 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.881 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 73.4 m 60.28 34.96 20.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.911 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -97.65 30.71 2.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.158 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -116.93 -179.78 17.67 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.503 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -132.84 127.5 4.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.53 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.0 t -89.03 141.19 28.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.814 0.34 . . . . 0.0 110.833 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.7 m -116.54 142.5 46.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.876 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.495 ' O ' HG13 ' A' ' 93' ' ' VAL . 11.1 p -62.27 118.65 4.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.092 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 166.19 80.34 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.535 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.421 ' CE3' ' HA ' ' A' ' 95' ' ' TRP . 0.1 OUTLIER -177.58 100.81 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.734 0.302 . . . . 0.0 110.843 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -143.71 44.32 1.49 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.977 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -173.89 136.88 0.67 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.981 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.13 167.62 25.61 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.458 2.105 . . . . 0.0 112.429 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.34 -16.71 31.14 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.624 2.216 . . . . 0.0 112.534 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.7 139.16 45.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.907 0.384 . . . . 0.0 111.257 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.71 134.35 21.31 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.83 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.32 151.92 27.64 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.405 2.07 . . . . 0.0 112.333 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.2 mm? 61.59 119.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.042 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -165.15 99.8 0.74 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.847 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.09 -52.38 4.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.916 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -101.5 146.33 32.03 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.958 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.53 138.77 30.22 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.506 2.137 . . . . 0.0 112.244 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 67.2 m -101.16 106.57 17.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.907 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 53.6 p -70.66 148.74 95.19 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.884 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.2 -170.21 0.47 Allowed 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.611 2.207 . . . . 0.0 112.303 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.407 ' N ' ' HD3' ' A' ' 112' ' ' PRO . . . -138.89 61.71 0.57 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.574 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.407 ' HD3' ' N ' ' A' ' 111' ' ' GLY . 36.5 Cg_exo -57.4 -177.34 0.08 OUTLIER 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.542 2.162 . . . . 0.0 112.242 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.69 84.91 0.2 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.022 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.65 158.4 55.89 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.58 2.187 . . . . 0.0 112.283 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 56.4 mtt-85 -74.29 108.22 6.95 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.92 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.8 p-10 -97.55 -32.13 11.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.872 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.652 HD12 ' HD3' ' A' ' 43' ' ' PRO . 0.3 OUTLIER -140.89 -69.69 0.38 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.812 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 39.9 m 61.04 -82.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.24 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.7 -169.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.063 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.649 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -131.73 -174.86 3.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.06 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.455 ' HD2' HG12 ' A' ' 155' ' ' VAL . 31.8 mttt -131.74 91.51 3.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.951 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -70.1 134.49 48.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.763 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.582 HG13 ' HB2' ' A' ' 148' ' ' ALA . 22.0 t -133.65 116.86 25.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.079 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.64 ' C ' HD22 ' A' ' 125' ' ' LEU . 5.1 m -62.46 164.5 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.984 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.777 HD23 ' HA ' ' A' ' 38' ' ' ALA . 4.4 mm? -124.48 33.55 5.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.911 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -145.33 35.93 1.09 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.891 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.5 tpt -178.67 -37.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.994 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.12 -169.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.306 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.537 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.4 OUTLIER -167.87 122.85 1.0 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.537 179.894 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.69 HG12 HD12 ' A' ' 176' ' ' ILE . 2.2 p -98.61 159.31 3.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.288 0.565 . . . . 0.0 111.525 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.473 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 12.5 m -162.94 157.7 21.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.743 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.412 ' HB3' ' NH1' ' A' ' 132' ' ' ARG . 12.7 ttp-105 -140.09 117.95 11.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.956 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -117.01 -175.1 2.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.831 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 26.0 p -111.5 -177.94 3.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.063 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 16.4 p -139.46 158.63 68.22 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.837 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -60.25 -17.03 44.12 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.765 2.31 . . . . 0.0 112.801 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.1 p -135.66 37.05 2.88 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.674 0.273 . . . . 0.0 111.112 -179.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.403 ' HA ' ' HD3' ' A' ' 139' ' ' PRO . 0.9 OUTLIER -77.55 111.14 15.42 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.934 179.931 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 138' ' ' ASP . 14.7 Cg_exo -68.85 -42.24 4.7 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.609 2.206 . . . . 0.0 111.971 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.5 ' CB ' ' HD3' ' A' ' 141' ' ' PRO . 1.6 mt-10 -164.25 -56.77 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.927 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.5 ' HD3' ' CB ' ' A' ' 140' ' ' GLU . 24.6 Cg_exo -62.85 106.27 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.376 2.051 . . . . 0.0 112.039 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.27 160.7 18.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.026 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -75.39 141.68 43.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.867 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.786 HD21 ' HB2' ' A' ' 169' ' ' ALA . 7.1 mt -120.39 126.51 50.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.793 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -134.53 132.16 38.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.885 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.547 HD13 HG21 ' A' ' 172' ' ' ILE . 18.5 mt -129.49 125.8 62.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.128 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 30.4 p -104.74 130.96 52.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.738 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -110.18 147.31 33.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.167 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.97 30.57 2.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.306 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -115.74 45.29 1.73 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.191 0.519 . . . . 0.0 110.139 179.433 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 118.68 22.16 3.73 Favored Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.191 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 58.74 61.65 2.13 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 121.14 0.495 . . . . 0.0 110.826 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.738 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 4.6 m-20 -88.12 158.96 18.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.802 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -157.21 85.44 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.191 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.455 HG12 ' HD2' ' A' ' 121' ' ' LYS . 4.7 m -80.0 123.82 37.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.192 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -105.91 106.54 17.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.644 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.607 ' CB ' HD22 ' A' ' 12' ' ' LEU . 2.1 mt -119.85 160.85 21.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.151 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.423 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 22.5 ttt180 -132.46 107.74 8.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.764 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.983 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -58.68 173.05 0.44 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.228 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.02 -29.4 14.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.888 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -123.66 143.99 49.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.906 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -45.96 82.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.962 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.71 -39.94 88.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.007 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 68.4 m -61.91 -48.92 78.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.686 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.983 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -59.52 -39.75 84.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.031 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 5.0 mtt85 -69.9 -46.71 64.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.41 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.5 t -64.51 -33.23 75.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.219 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.774 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -72.93 -51.25 19.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.845 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.786 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -55.72 -56.26 22.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.309 0.576 . . . . 0.0 110.516 179.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.41 -36.85 78.79 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.752 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -71.84 -39.86 69.46 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.157 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.547 HG21 HD13 ' A' ' 146' ' ' ILE . 7.4 mt -63.58 -22.2 30.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.606 -0.886 . . . . 0.0 108.606 177.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.577 ' N ' HG11 ' A' ' 130' ' ' VAL . 1.2 tp60 -77.76 -40.88 39.45 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.483 179.546 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 174' ' ' ALA . . . . . 0.816 ' HA ' HG22 ' A' ' 178' ' ' THR . . . -65.49 -33.05 75.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.766 179.721 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 175' ' ' GLN . . . . . 0.408 ' HB3' HD12 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -82.58 -29.39 30.29 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.09 179.268 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.69 HD12 HG12 ' A' ' 130' ' ' VAL . 17.2 mt -71.59 -27.75 29.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.691 179.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 115.56 39.22 0.93 Allowed Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.612 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 178' ' ' THR . . . . . 0.816 HG22 ' HA ' ' A' ' 174' ' ' ALA . 1.6 t . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.182 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.898 0.38 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.08 -175.39 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.96 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 167.29 178.17 39.38 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.46 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 5.5 ttt85 -131.08 -47.07 1.01 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.789 0.328 . . . . 0.0 110.863 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.63 97.24 2.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.897 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -165.03 88.56 1.01 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.15 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -69.3 156.08 65.56 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 122.552 2.168 . . . . 0.0 112.356 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.491 ' HD2' HD23 ' A' ' 34' ' ' LEU . 4.3 ptp180 -112.93 135.69 53.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.868 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.4 p -124.61 168.44 13.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.966 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.55 126.71 1.25 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.47 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.502 HD22 ' HD3' ' A' ' 29' ' ' ARG . 10.5 mt -59.68 128.05 35.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.843 0.354 . . . . 0.0 110.932 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.853 HD21 HD12 ' A' ' 144' ' ' LEU . 0.2 OUTLIER -145.48 140.68 27.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.806 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.95 154.93 37.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.939 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 16.1 tp -134.73 130.96 37.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.452 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.506 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 2.6 ttp180 -69.38 166.98 17.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.801 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.4 t -124.91 -43.13 2.0 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.849 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 131.37 170.31 12.61 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.598 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.58 131.34 38.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.875 0.369 . . . . 0.0 111.085 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 128.53 52.16 0.12 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.524 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 p -145.26 -58.9 0.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.771 0.319 . . . . 0.0 110.933 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -145.32 -142.29 3.8 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.542 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -81.32 139.63 35.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.752 0.31 . . . . 0.0 111.175 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.93 -49.48 0.88 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.499 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 100.62 24.66 9.16 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.568 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -155.09 149.61 26.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.835 0.35 . . . . 0.0 110.799 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.525 HH21 HD23 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -131.47 49.17 2.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.825 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.506 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 43.0 m95 -48.13 160.13 0.16 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.02 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -153.17 158.08 41.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.095 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.502 ' HD3' HD22 ' A' ' 11' ' ' LEU . 1.5 ttm180 -82.34 123.56 29.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.946 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.682 HG12 ' HA ' ' A' ' 43' ' ' PRO . 20.5 m -143.31 123.22 9.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.209 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 11' ' ' LEU . 1.0 OUTLIER -69.85 134.85 48.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.613 179.762 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.84 121.85 41.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.979 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.2 t -100.37 86.0 3.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.694 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.501 HD12 ' CG ' ' A' ' 39' ' ' LEU . 1.7 tp -80.27 129.65 34.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.028 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.655 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -135.26 138.67 43.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.06 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.72 -23.69 44.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.037 0.446 . . . . 0.0 111.285 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -88.83 -30.15 19.16 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.929 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.655 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -175.41 173.01 2.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.032 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.501 ' CG ' HD12 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -114.71 129.01 56.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.942 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.496 ' CG2' ' HB1' ' A' ' 120' ' ' ALA . 28.6 m -128.33 129.65 46.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.752 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.461 HG12 ' N ' ' A' ' 42' ' ' SER . 13.9 t -107.28 159.02 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.317 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.461 ' N ' HG12 ' A' ' 41' ' ' VAL . 11.3 t -159.59 149.0 14.46 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.451 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.682 ' HA ' HG12 ' A' ' 30' ' ' VAL . 66.7 Cg_endo -75.07 43.03 0.92 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.654 2.236 . . . . 0.0 113.23 -179.663 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 45.52 29.51 0.63 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.939 0.399 . . . . 0.0 111.846 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -111.56 -168.52 1.32 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.017 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -112.85 -158.44 13.47 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.484 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -144.73 92.98 5.77 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.651 0.262 . . . . 0.0 110.959 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -68.57 163.1 38.17 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.466 2.111 . . . . 0.0 112.284 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -108.21 -94.5 2.34 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.547 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.65 108.56 0.26 Allowed 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.554 2.169 . . . . 0.0 112.326 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -147.86 138.75 13.21 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.793 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.16 135.68 27.66 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.424 2.083 . . . . 0.0 112.299 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -73.49 116.04 47.43 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.788 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.32 63.79 1.54 Allowed 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.41 2.073 . . . . 0.0 112.287 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -152.67 155.3 37.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.097 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.24 93.52 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.888 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.8 mt -76.21 -54.7 6.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.923 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.3 t30 60.84 31.26 20.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.849 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.0 -158.89 22.28 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.549 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.58 105.16 3.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.863 0.363 . . . . 0.0 111.129 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -107.11 135.07 49.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.029 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -80.99 135.19 51.73 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.877 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.49 127.21 10.86 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.511 2.141 . . . . 0.0 112.325 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -109.77 147.53 17.15 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.514 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.14 -177.35 0.11 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.767 0.318 . . . . 0.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -130.26 99.31 19.61 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.066 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.86 157.43 61.83 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.43 2.087 . . . . 0.0 112.303 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.467 ' HB3' HD11 ' A' ' 74' ' ' LEU . 56.5 Cg_endo -70.79 136.16 29.63 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.617 2.211 . . . . 0.0 112.358 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -98.61 126.2 44.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.908 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.525 HD23 HH21 ' A' ' 26' ' ' ARG . 1.0 OUTLIER 60.05 108.61 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.841 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -57.59 -160.7 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.47 2.113 . . . . 0.0 112.21 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.549 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.8 mt-10 66.3 74.5 0.35 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.458 0.647 . . . . 0.0 110.211 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 165.0 -28.67 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.795 -1.093 . . . . 0.0 110.327 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.467 HD11 ' HB3' ' A' ' 68' ' ' PRO . 7.6 mt -115.19 -18.66 11.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.193 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.767 HD22 ' O ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -99.43 -2.72 35.39 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.555 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.541 ' H ' HD23 ' A' ' 76' ' ' LEU . 2.6 pt? -57.43 -44.39 84.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.765 0.317 . . . . 0.0 111.489 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.48 ' N ' ' HG ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER 46.86 28.59 0.86 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.391 179.889 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -120.73 -36.18 3.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.186 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -98.99 31.63 2.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.903 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.4 t -143.76 -46.4 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.187 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 9.9 t 62.85 142.98 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.966 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.09 59.06 6.4 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.619 2.213 . . . . 0.0 112.424 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -170.29 74.04 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.894 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -155.99 153.48 29.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.946 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt -65.73 158.72 26.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.937 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -126.88 31.33 5.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.952 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.96 92.18 8.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.837 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -164.04 174.09 11.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.038 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 166.57 -148.92 14.12 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.56 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.481 ' O ' HG22 ' A' ' 91' ' ' THR . . . 126.12 58.6 0.15 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.501 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.481 HG22 ' O ' ' A' ' 90' ' ' GLY . 15.1 t 45.19 -167.22 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.812 0.339 . . . . 0.0 111.315 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 56.1 m -90.82 113.45 25.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.903 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.9 p -88.64 148.66 4.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.131 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 155.57 -61.31 0.36 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.488 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER 60.68 83.98 0.13 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.855 0.36 . . . . 0.0 110.914 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -176.68 67.53 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.854 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 66.7 m -115.6 84.84 12.88 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.063 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.448 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 55.8 Cg_exo -52.15 128.12 26.06 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.594 2.196 . . . . 0.0 112.172 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 98' ' ' PRO . 22.7 Cg_exo -64.29 -27.13 63.76 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.379 2.053 . . . . 0.0 112.09 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -132.76 127.7 35.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.021 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.3 p -117.48 86.22 22.22 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.917 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -69.01 147.07 66.9 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.599 2.2 . . . . 0.0 112.255 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.54 100.62 9.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -105.63 160.66 15.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.819 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.47 149.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.89 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.4 138.82 89.13 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.812 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.19 168.24 0.61 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.485 2.123 . . . . 0.0 112.294 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.9 t -91.34 166.22 13.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.878 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.429 ' CB ' ' CD ' ' A' ' 110' ' ' PRO . 0.4 OUTLIER 179.41 -60.89 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.068 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 109' ' ' SER . 62.8 Cg_endo -74.33 125.16 9.49 Favored 'Trans proline' 0 N--CA 1.466 -0.145 0 C-N-CA 122.855 2.37 . . . . 0.0 112.315 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 77.4 105.77 0.16 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.46 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -49.53 164.06 0.38 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.539 2.16 . . . . 0.0 112.367 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -75.23 147.5 82.98 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.08 162.13 42.66 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.557 2.172 . . . . 0.0 112.301 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.38 177.75 10.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.824 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -69.21 -45.57 69.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.783 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 19.6 tp -166.53 115.98 0.92 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.907 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 2.7 m -111.77 -33.52 6.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.987 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -111.63 -177.94 3.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.97 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.496 ' HB1' ' CG2' ' A' ' 40' ' ' THR . . . -86.67 154.36 21.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.187 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 94.11 6.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.803 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -86.33 104.54 15.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.996 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.2 t -108.19 139.89 28.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.039 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.9 152.21 19.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.961 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.423 HD13 ' HB2' ' A' ' 39' ' ' LEU . 4.8 tp -131.95 31.47 4.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.903 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.95 41.74 2.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.724 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 174.88 -32.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.914 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.32 -171.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.378 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -161.23 107.1 1.38 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.587 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.599 HG11 ' N ' ' A' ' 173' ' ' GLN . 1.6 p -80.23 158.64 4.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.233 0.539 . . . . 0.0 111.359 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.472 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.4 OUTLIER -160.48 150.04 17.53 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.646 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.5 ptt85 -124.0 111.48 16.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.086 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.49 177.74 4.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.816 179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 30.5 p -100.66 137.38 39.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.989 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.559 HG22 ' HD2' ' A' ' 136' ' ' PRO . 0.2 OUTLIER -101.07 140.7 21.51 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.744 179.938 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 136' ' ' PRO . . . . . 0.559 ' HD2' HG22 ' A' ' 135' ' ' THR . 72.6 Cg_endo -76.22 -15.59 18.05 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.593 2.195 . . . . 0.0 112.659 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 66.6 p -78.03 -45.31 24.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.917 0.389 . . . . 0.0 111.068 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -136.19 144.87 49.74 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.906 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -83.6 -44.84 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.753 2.302 . . . . 0.0 112.789 -179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.492 ' CB ' ' HD3' ' A' ' 141' ' ' PRO . 0.2 OUTLIER -64.87 -57.66 15.4 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.316 -179.514 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.492 ' HD3' ' CB ' ' A' ' 140' ' ' GLU . 46.1 Cg_exo -56.29 103.86 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.344 2.029 . . . . 0.0 112.221 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.58 116.98 20.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.737 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.44 ' HD2' HG23 ' A' ' 135' ' ' THR . 1.9 t80 -57.89 119.41 6.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.829 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.853 HD12 HD21 ' A' ' 12' ' ' LEU . 91.4 mt -96.2 139.88 31.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.918 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -148.1 130.02 15.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.729 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 14.8 mt -130.89 123.26 53.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.295 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 60.1 m -108.42 119.38 39.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.667 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -100.11 143.14 30.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.377 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.58 30.89 2.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.167 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -121.35 47.8 1.78 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.381 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 125.69 18.7 2.39 Favored Glycine 0 CA--C 1.519 0.292 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.524 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 58.95 60.93 2.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.973 0.416 . . . . 0.0 110.925 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -93.44 152.94 18.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.713 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -160.49 86.88 0.74 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.085 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 155' ' ' VAL . 35.5 m -84.12 124.83 40.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.111 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -109.47 102.47 11.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.904 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.0 mt -113.67 167.99 10.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.136 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.452 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 5.5 ttt-85 -144.4 97.6 3.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.702 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 1.049 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.69 171.28 0.22 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.423 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.42 -30.54 13.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.029 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -105.97 164.83 11.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.893 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -79.98 -65.31 1.02 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.958 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -60.04 -26.79 66.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.151 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 4.5 t -68.96 -43.49 74.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.908 0.385 . . . . 0.0 110.282 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 1.049 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -73.31 -28.23 61.97 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.544 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 11.1 ptt85 -79.28 -40.48 30.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.429 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.3 t -70.95 -31.76 68.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.108 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.487 ' O ' HD12 ' A' ' 172' ' ' ILE . 9.9 m95 -71.51 -47.4 55.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.854 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.424 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -58.17 -48.95 78.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.263 0.554 . . . . 0.0 110.465 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.45 -42.48 95.85 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.581 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.89 -40.76 75.47 Favored 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 120.854 -0.338 . . . . 0.0 110.746 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.56 ' C ' HG11 ' A' ' 130' ' ' VAL . 11.8 mt -61.11 -23.12 28.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.599 ' N ' HG11 ' A' ' 130' ' ' VAL . 1.2 tt0 -77.74 -42.1 35.41 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.618 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 174' ' ' ALA . . . . . 0.49 ' HA ' HG22 ' A' ' 178' ' ' THR . . . -64.82 -43.68 92.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.487 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 74.6 mm-40 -67.28 -37.23 83.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.074 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.404 HD13 HG22 ' A' ' 172' ' ' ILE . 0.1 OUTLIER -59.8 -33.27 51.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.694 179.494 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 124.84 54.29 0.18 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.593 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 178' ' ' THR . . . . . 0.49 HG22 ' HA ' ' A' ' 174' ' ' ALA . 4.7 t . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.072 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.823 0.344 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.6 p -99.1 114.32 26.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.852 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.93 82.41 1.68 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.499 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -163.49 96.25 0.85 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.783 0.325 . . . . 0.0 110.839 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.73 98.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.817 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.36 112.58 5.39 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.116 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -67.31 160.64 46.74 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.399 2.066 . . . . 0.0 112.309 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -110.61 144.85 38.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.739 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.667 HG22 ' HA ' ' A' ' 33' ' ' SER . 18.2 p -133.32 164.03 28.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -158.08 118.64 0.84 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.338 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.853 HD22 ' HD3' ' A' ' 29' ' ' ARG . 17.8 mt -59.44 93.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.843 0.354 . . . . 0.0 110.913 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.812 HD13 HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -96.32 170.04 9.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.787 -179.994 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -110.94 146.93 35.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.964 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 14.6 tp -125.37 142.99 51.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.738 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.478 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER -69.44 170.58 10.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.697 -179.837 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -170.26 34.75 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.897 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -111.03 166.81 12.33 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.501 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.514 ' HB3' HD21 ' A' ' 70' ' ' LEU . . . -134.68 39.07 3.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.807 0.337 . . . . 0.0 111.098 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.04 174.77 29.4 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.482 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.4 m -127.45 132.4 50.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.841 0.353 . . . . 0.0 110.871 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.15 23.71 5.99 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.589 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 56.2 -168.67 0.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.84 0.353 . . . . 0.0 111.183 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 136.15 -53.49 0.76 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.462 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -174.73 53.41 0.13 Allowed Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.492 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -59.79 150.38 28.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.869 0.366 . . . . 0.0 110.917 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -109.12 46.63 0.97 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.952 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.478 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 12.1 m95 -54.26 91.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.904 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -65.95 178.97 0.97 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.136 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.853 ' HD3' HD22 ' A' ' 11' ' ' LEU . 3.8 tmm_? -117.92 110.82 18.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.824 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.839 HG12 ' HA ' ' A' ' 43' ' ' PRO . 29.0 m -113.96 138.44 43.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.157 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.0 tp -83.69 127.42 33.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.561 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.828 HD12 HG13 ' A' ' 41' ' ' VAL . 2.6 mp -98.16 101.28 12.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.119 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.667 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.7 OUTLIER -86.45 94.03 9.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.648 179.735 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.523 HD12 HD11 ' A' ' 39' ' ' LEU . 2.1 tp -87.69 129.81 35.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.992 -179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -135.72 140.07 44.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.972 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.7 -23.09 49.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.072 0.463 . . . . 0.0 111.251 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -86.47 -30.85 21.71 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.93 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.546 ' HA ' HD22 ' A' ' 125' ' ' LEU . . . -178.16 -178.66 0.67 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.99 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.523 HD11 HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -113.37 157.6 21.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.922 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.486 HG23 ' CE1' ' A' ' 122' ' ' HIS . 24.7 m -158.24 128.02 5.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.626 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.828 HG13 HD12 ' A' ' 32' ' ' LEU . 10.7 t -119.78 157.97 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.012 0.434 . . . . 0.0 111.348 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.452 ' N ' HG12 ' A' ' 41' ' ' VAL . 12.5 t -160.1 157.57 25.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.406 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.839 ' HA ' HG12 ' A' ' 30' ' ' VAL . 7.0 Cg_exo -73.85 39.56 0.52 Allowed 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.732 2.288 . . . . 0.0 112.973 -179.57 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 44.98 29.56 0.48 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.018 0.437 . . . . 0.0 111.404 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -115.64 172.63 7.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.884 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -91.44 81.16 1.26 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.468 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -61.81 154.12 68.7 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.807 0.337 . . . . 0.0 110.908 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.67 165.34 27.89 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.513 2.142 . . . . 0.0 112.314 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -117.38 -147.8 8.61 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.485 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -68.9 -27.8 30.32 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.648 2.232 . . . . 0.0 112.264 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -145.89 91.36 5.62 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.964 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.01 -167.66 0.17 Allowed 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 122.546 2.164 . . . . 0.0 112.338 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -138.26 107.8 8.01 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.884 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -50.83 141.06 36.85 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.487 2.125 . . . . 0.0 112.387 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -99.92 -177.76 3.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.197 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.6 110.48 20.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.849 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 5.6 mt -74.48 -50.57 17.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 68.86 -67.51 0.21 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.999 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -170.57 -132.22 1.44 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.474 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . 59.93 168.83 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.827 0.346 . . . . 0.0 111.124 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.88 -175.56 0.31 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.081 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -144.53 142.08 18.79 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.915 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -73.78 164.74 33.95 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.535 2.157 . . . . 0.0 112.335 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 172.56 62.17 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.531 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.89 145.59 55.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 0.0 111.064 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.495 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -91.92 148.72 37.56 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.095 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.487 ' N ' ' CD ' ' A' ' 68' ' ' PRO . 31.7 Cg_exo -56.99 -46.23 30.53 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.46 2.107 . . . . 0.0 112.802 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.495 ' HD2' ' HB1' ' A' ' 66' ' ' ALA . 94.3 Cg_endo -82.35 -169.66 0.79 Allowed 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.891 2.394 . . . . 0.0 112.371 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.66 152.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.9 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.782 HD13 ' HD2' ' A' ' 71' ' ' PRO . 0.2 OUTLIER -100.61 121.88 51.4 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.733 179.984 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.782 ' HD2' HD13 ' A' ' 70' ' ' LEU . 31.8 Cg_exo -58.31 -156.42 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.447 2.098 . . . . 0.0 112.262 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 65.38 72.1 0.43 Allowed 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.516 0.674 . . . . 0.0 110.543 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -177.96 -43.08 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.813 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.41 ' N ' HD12 ' A' ' 74' ' ' LEU . 5.8 mp -100.4 6.49 44.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.28 178.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.856 HD22 ' O ' ' A' ' 75' ' ' LEU . 0.2 OUTLIER -113.44 -37.41 4.66 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.535 -179.654 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.825 HD13 ' N ' ' A' ' 77' ' ' GLN . 0.1 OUTLIER -87.23 -51.0 6.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.652 179.999 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.825 ' N ' HD13 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -67.1 127.02 31.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 179.977 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.77 -60.76 0.33 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.851 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -97.38 36.75 1.43 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.937 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.3 t -112.5 -50.86 5.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.116 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.6 t -89.39 142.9 30.05 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.947 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.07 59.03 6.38 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.579 2.186 . . . . 0.0 112.426 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -176.29 38.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.859 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -147.42 97.4 2.85 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.87 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -132.2 126.09 32.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.921 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -141.35 114.83 8.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.904 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 63.58 125.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.896 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 60.93 165.36 0.08 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.102 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 102.42 -53.1 0.79 Allowed Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.51 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -158.49 70.74 0.25 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.547 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 70.0 p -95.56 154.66 17.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 110.902 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.63 21.72 1.65 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.111 0.482 . . . . 0.0 111.081 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.467 HG22 ' N ' ' A' ' 94' ' ' GLY . 11.2 p -78.19 157.05 5.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.044 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.467 ' N ' HG22 ' A' ' 93' ' ' VAL . . . -176.14 -38.3 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.528 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 -119.82 72.51 0.93 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.944 0.402 . . . . 0.0 110.898 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.64 45.05 1.61 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.943 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.8 m -130.52 142.99 47.47 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.938 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.481 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 51.4 Cg_exo -54.4 130.07 38.0 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.434 2.089 . . . . 0.0 112.208 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 98' ' ' PRO . 16.1 Cg_exo -67.85 -27.25 37.51 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.444 2.096 . . . . 0.0 111.899 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -144.31 146.17 32.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.041 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -176.72 86.05 0.26 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.842 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.54 61.96 3.6 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.574 2.182 . . . . 0.0 112.239 179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 103' ' ' LEU . 4.4 mm? -115.49 124.68 51.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.891 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -88.7 -38.75 14.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.91 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -70.89 178.66 3.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.812 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.18 146.65 34.33 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.854 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.26 173.19 13.43 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.483 2.122 . . . . 0.0 112.328 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.58 111.25 13.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.836 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.9 m -137.84 89.1 15.36 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.917 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.22 146.82 64.79 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.555 2.17 . . . . 0.0 112.313 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -79.06 152.6 36.73 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.483 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.69 148.85 26.65 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.621 2.214 . . . . 0.0 112.268 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -128.24 139.21 34.81 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.909 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.28 90.69 1.17 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.575 2.183 . . . . 0.0 112.339 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.3 mtp180 -94.64 164.94 12.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.916 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -139.55 -48.78 0.48 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.929 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.514 HD12 ' O ' ' A' ' 117' ' ' LEU . 4.2 pp -135.17 136.47 41.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.888 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.5 -32.61 12.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.008 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -87.69 121.14 29.75 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.878 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.694 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -71.09 -177.71 1.76 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.071 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.572 ' HD2' HG11 ' A' ' 155' ' ' VAL . 18.1 mttm -121.07 108.86 14.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.897 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.486 ' CE1' HG23 ' A' ' 40' ' ' THR . 17.9 m-70 -109.92 144.63 38.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.949 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.643 HG13 ' HB2' ' A' ' 148' ' ' ALA . 4.0 t -123.39 127.32 74.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.869 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 56.4 p -58.27 -30.19 66.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.231 -179.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.546 HD22 ' HA ' ' A' ' 38' ' ' ALA . 2.1 mp 65.05 31.01 11.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.928 0.394 . . . . 0.0 110.832 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.18 36.12 3.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.716 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.588 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 1.5 mtp 170.01 -28.85 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.896 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -51.32 -177.86 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.976 0.417 . . . . 0.0 111.574 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -165.08 115.97 1.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.514 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.574 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -89.66 158.61 2.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.287 0.565 . . . . 0.0 111.487 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -167.92 128.08 1.34 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.707 -179.947 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.27 112.21 24.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.083 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -90.77 174.25 7.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.762 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 1.2 m -105.64 163.47 12.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.015 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.703 HG23 ' CE2' ' A' ' 143' ' ' TYR . 1.7 m -127.41 116.68 21.41 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.815 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -54.18 -39.29 86.82 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.48 2.12 . . . . 0.0 112.35 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.92 -32.79 34.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.096 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.408 ' HB3' ' CG ' ' A' ' 141' ' ' PRO . 2.5 m-20 -127.03 75.34 76.62 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.838 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -59.67 -23.73 72.7 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.673 2.248 . . . . 0.0 112.572 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.453 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.8 OUTLIER -67.41 -64.49 2.03 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.2 -179.701 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.453 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 66.8 Cg_endo -73.7 130.15 14.37 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.4 2.066 . . . . 0.0 112.442 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.05 121.83 38.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.762 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.703 ' CE2' HG23 ' A' ' 135' ' ' THR . 4.9 m-85 -57.33 112.93 1.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.989 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.567 HD21 ' N ' ' A' ' 169' ' ' ALA . 1.1 mt -83.32 88.93 6.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.878 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -96.51 137.81 35.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.965 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.793 HD13 HG21 ' A' ' 172' ' ' ILE . 25.2 mt -141.46 126.76 18.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.035 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 63.8 m -114.22 130.6 56.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.049 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.643 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -112.15 152.03 28.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.103 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.588 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.87 30.96 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.356 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -111.03 42.41 1.64 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.336 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.22 26.79 1.96 Allowed Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.354 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 57.59 59.24 3.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.106 0.479 . . . . 0.0 111.006 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' ASP . . . . . 0.443 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 0.7 OUTLIER -90.13 152.3 21.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.774 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.13 94.23 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.056 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.572 HG11 ' HD2' ' A' ' 121' ' ' LYS . 10.8 m -95.76 132.98 38.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.169 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.449 ' CD1' ' N ' ' A' ' 156' ' ' PHE . 0.7 OUTLIER -119.06 98.77 6.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.897 179.918 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.58 HD13 HD21 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -106.02 167.92 9.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.937 -179.922 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 158' ' ' ARG . . . . . 0.446 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.9 OUTLIER -129.46 107.34 9.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.776 179.976 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.789 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -59.39 173.45 0.51 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.15 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.23 -30.14 16.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.039 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -122.53 157.78 31.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.929 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.09 -42.62 69.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.062 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.7 76.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.98 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 60.4 p -63.9 -44.26 93.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.653 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.789 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -62.84 -43.86 97.68 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.923 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.67 -42.4 77.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.484 179.706 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 91.1 p -66.57 -34.67 78.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.2 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 168' ' ' TRP . . . . . 0.491 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 12.1 m95 -73.0 -50.13 24.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.785 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 169' ' ' ALA . . . . . 0.567 ' N ' HD21 ' A' ' 144' ' ' LEU . . . -56.31 -51.13 69.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.271 0.557 . . . . 0.0 110.592 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.73 -41.31 95.79 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.71 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.41 -41.33 80.6 Favored 'General case' 0 CA--C 1.511 -0.544 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.141 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.873 HG22 HD12 ' A' ' 176' ' ' ILE . 7.0 mt -62.41 -23.38 32.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.574 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.0 OUTLIER -79.97 -30.73 39.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.353 179.286 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -66.36 -47.03 74.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.423 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -71.05 -37.02 72.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.234 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 176' ' ' ILE . . . . . 0.873 HD12 HG22 ' A' ' 172' ' ' ILE . 70.3 mt -83.33 -5.95 9.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.373 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -88.12 27.42 6.81 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.321 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.911 -179.939 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo . . . . . 0 N--CA 1.466 -0.134 0 CA-C-O 120.74 0.225 . . . . 0.0 112.281 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.5 ttm-85 -82.56 130.25 35.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.559 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.805 HG22 ' HA ' ' A' ' 33' ' ' SER . 21.7 p -120.65 146.37 46.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.971 0.415 . . . . 0.0 111.224 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -134.73 127.69 4.54 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.465 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' A' ' 11' ' ' LEU . 8.1 mt -69.82 101.24 1.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.944 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.812 HD13 HD22 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -121.23 164.2 17.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.717 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.688 ' O ' HD23 ' A' ' 157' ' ' LEU . 0.9 OUTLIER -89.55 163.79 15.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.959 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.452 ' HB2' HG21 ' A' ' 30' ' ' VAL . 18.1 tp -137.53 124.67 21.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.665 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.48 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 33.8 ttt180 . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.657 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.48 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.4 m95 . . . . . 0 CA--C 1.528 0.098 0 CA-C-O 120.807 0.336 . . . . 0.0 111.167 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -166.63 141.61 4.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -64.2 136.04 56.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.007 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.452 HG21 ' HB2' ' A' ' 14' ' ' LEU . 31.6 m -146.36 169.98 5.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.12 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.478 HD23 ' HA ' ' A' ' 31' ' ' LEU . 0.7 OUTLIER -107.17 141.62 38.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.725 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 1.117 HD21 HD13 ' A' ' 157' ' ' LEU . 9.9 mp -114.54 82.84 1.79 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.901 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.805 ' HA ' HG22 ' A' ' 9' ' ' THR . 1.0 OUTLIER -69.95 88.9 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.58 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.109 HD12 HD23 ' A' ' 39' ' ' LEU . 1.7 tp -87.73 119.18 27.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.236 -179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -109.79 156.07 20.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.815 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -49.9 -22.82 1.64 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.793 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.444 ' HA ' HD12 ' A' ' 125' ' ' LEU . 3.6 p30 -152.87 38.14 0.51 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.204 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.564 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -175.2 119.92 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.957 0.408 . . . . 0.0 111.646 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 1.109 HD23 HD12 ' A' ' 34' ' ' LEU . 3.0 tm? -104.16 100.88 10.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.496 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.412 ' HG1' ' CE1' ' A' ' 122' ' ' HIS . 85.5 m -109.78 126.75 54.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.369 -179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.603 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 11.5 t -94.56 158.57 2.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.391 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.417 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -149.52 166.4 15.33 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.904 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -82.6 50.72 3.49 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.658 2.238 . . . . 0.0 112.46 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.188 -179.867 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.603 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 120.85 0.357 . . . . 0.0 111.084 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.59 82.8 2.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.928 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.412 ' CE1' ' HG1' ' A' ' 40' ' ' THR . 14.5 m-70 -76.18 135.62 39.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.829 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.558 HG11 ' HB2' ' A' ' 148' ' ' ALA . 21.5 t -138.62 120.77 17.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.116 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 5.6 m -59.69 151.38 25.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.858 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 37' ' ' ASP . 59.7 mt -109.32 38.08 2.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.899 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.93 34.23 4.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.833 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.561 ' HB2' ' HB3' ' A' ' 149' ' ' ALA . 10.5 ptt? 179.3 -36.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.044 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.85 -176.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.379 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.699 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.0 OUTLIER -167.44 125.79 1.28 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.472 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.586 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.2 p -94.19 159.18 2.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 121.255 0.55 . . . . 0.0 111.406 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' HG22 ' A' ' 130' ' ' VAL . 34.4 p -157.85 134.89 10.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.86 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 9.8 ttm105 -96.15 95.64 8.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.874 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.95 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.858 0.361 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.564 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.2 OUTLIER -121.0 140.55 51.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.794 179.892 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . 0.435 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 6.0 tm-20 -148.68 126.49 11.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.826 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.782 HD11 HD13 ' A' ' 172' ' ' ILE . 29.6 mt -126.41 118.51 51.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.161 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 7.8 m -99.56 138.15 37.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.814 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.626 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -114.24 149.07 36.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.219 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.561 ' HB3' ' HB2' ' A' ' 127' ' ' MET . . . -95.14 30.4 2.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.286 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -115.23 45.03 1.71 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.186 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.3 22.73 3.37 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.132 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.407 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.6 mm-40 58.1 61.06 2.45 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.17 0.51 . . . . 0.0 110.968 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.626 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.1 m-20 -87.43 157.67 19.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.911 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -156.47 90.93 1.2 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.119 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 7.3 m -84.61 118.66 32.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.233 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.435 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 70.2 m-85 -106.18 116.19 31.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.749 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 1.117 HD13 HD21 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -127.18 160.58 30.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.03 -179.742 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.457 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 5.2 tmm_? -135.78 94.11 3.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.811 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 1.023 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -54.92 172.35 0.11 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.366 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.07 -32.66 11.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.885 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -98.32 162.39 13.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.931 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.46 -51.64 6.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.955 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -69.07 -30.62 68.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 20.2 m -67.66 -52.84 33.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.652 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 1.023 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -61.34 -35.83 78.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.976 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -43.62 54.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.491 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 5.1 m -67.75 -30.15 69.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.046 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.575 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 5.4 m95 -71.28 -50.95 27.35 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.972 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.564 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -56.09 -51.52 67.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.325 0.583 . . . . 0.0 110.575 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -56.81 -41.03 90.63 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.58 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.21 -40.58 77.91 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.842 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.787 HG22 HD12 ' A' ' 176' ' ' ILE . 18.3 mt -60.07 -24.68 30.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.586 ' N ' HG11 ' A' ' 130' ' ' VAL . 4.2 tt0 -82.52 -28.35 31.14 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.255 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.11 -49.67 69.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.116 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -68.74 -41.07 79.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.75 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.787 HD12 HG22 ' A' ' 172' ' ' ILE . 91.7 mt -76.79 -7.55 10.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.282 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.481 179.85 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo . . . . . 0 C--O 1.23 0.124 0 CA-C-O 120.889 0.287 . . . . 0.0 112.284 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -79.39 141.04 37.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.775 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.8 p -139.17 138.8 37.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.058 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -146.18 127.25 2.72 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.418 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.2 mt -59.03 103.99 0.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.775 0.322 . . . . 0.0 110.985 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.467 HD22 ' CB ' ' A' ' 157' ' ' LEU . 0.1 OUTLIER -103.2 170.13 8.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.723 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -114.66 151.64 33.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.003 0.43 . . . . 0.0 111.123 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.408 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 1.2 tp -137.48 142.38 41.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.407 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.583 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 120.887 0.375 . . . . 0.0 110.891 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.583 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 12.8 m95 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.783 0.325 . . . . 0.0 110.829 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.85 179.11 6.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.907 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.4 ttp180 -112.32 133.41 54.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.895 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.85 HG12 ' HA ' ' A' ' 43' ' ' PRO . 27.7 m -139.54 120.91 15.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.206 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.9 tp -71.53 128.99 37.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.596 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.423 HD12 HG13 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -95.27 132.16 40.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.026 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -108.97 84.97 2.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.778 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.3 tp -82.0 108.88 15.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.997 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.58 146.39 44.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.022 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -61.5 -16.24 45.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.485 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -95.3 -25.51 16.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.994 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.437 ' HA ' HD22 ' A' ' 125' ' ' LEU . . . -179.07 178.52 0.73 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.917 0.389 . . . . 0.0 111.089 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.533 ' HB2' HD13 ' A' ' 125' ' ' LEU . 0.2 OUTLIER -123.07 113.12 18.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.801 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 56.5 m -116.8 134.16 55.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.942 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.474 HG12 ' N ' ' A' ' 42' ' ' SER . 11.1 t -115.8 159.77 15.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.17 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.474 ' N ' HG12 ' A' ' 41' ' ' VAL . 6.2 t -155.56 157.8 31.67 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.553 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.85 ' HA ' HG12 ' A' ' 30' ' ' VAL . 3.1 Cg_exo -75.24 44.43 1.2 Allowed 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.943 2.429 . . . . 0.0 112.725 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.152 0 CA-C-O 120.917 0.389 . . . . 0.0 111.348 179.838 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.059 0 CA-C-O 120.871 0.367 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.56 88.64 2.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.922 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 14.8 m-70 -85.8 139.53 31.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.062 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.47 HG12 ' H ' ' A' ' 125' ' ' LEU . 11.2 t -122.87 120.87 61.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.882 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.99 -28.31 16.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.317 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.533 HD13 ' HB2' ' A' ' 39' ' ' LEU . 1.2 tp 62.69 -174.38 0.15 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.754 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt 57.54 37.2 27.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.835 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.72 ' HG2' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -178.99 -36.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.925 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.631 ' HB3' HG13 ' A' ' 176' ' ' ILE . . . -56.08 -169.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.071 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.4 ' HA ' HG21 ' A' ' 176' ' ' ILE . 13.1 t80 -161.89 116.56 1.93 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.956 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.589 HG11 ' C ' ' A' ' 172' ' ' ILE . 1.4 p -97.08 158.69 3.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.184 0.516 . . . . 0.0 111.154 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.2 m -163.88 156.41 17.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.84 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 19.7 ttp-105 -122.54 93.67 4.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.978 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.72 179.826 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.405 ' CE1' ' HD2' ' A' ' 158' ' ' ARG . 3.4 m-30 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.759 0.314 . . . . 0.0 110.937 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.808 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.5 OUTLIER -90.33 98.75 11.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.655 179.862 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . 0.401 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 8.3 tm-20 -102.74 132.09 49.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.976 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.514 HG12 HG21 ' A' ' 172' ' ' ILE . 5.1 mp -135.74 111.58 12.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.906 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.5 m -100.6 134.09 44.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.873 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.754 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -108.11 145.31 34.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.283 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.72 ' HB3' ' HG2' ' A' ' 127' ' ' MET . . . -96.56 31.55 2.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.104 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -125.35 50.1 1.83 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.283 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 126.13 14.61 2.98 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.663 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 61.06 62.93 1.33 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.063 0.459 . . . . 0.0 110.896 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.754 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 81.0 m-20 -92.15 151.84 20.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.758 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . 0.447 ' HB1' ' CE1' ' A' ' 156' ' ' PHE . . . -157.8 91.81 1.16 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.069 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 155' ' ' VAL . 14.0 m -94.36 115.73 33.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.301 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.447 ' CE1' ' HB1' ' A' ' 154' ' ' ALA . 8.8 m-85 -105.21 89.59 3.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.554 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.467 ' CB ' HD22 ' A' ' 12' ' ' LEU . 1.1 mt -104.88 167.96 9.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.302 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.469 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 14.7 ttt-85 -127.43 103.16 7.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.616 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.909 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.01 173.57 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.294 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -77.49 -69.54 0.53 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.068 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -110.25 177.6 4.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.04 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.85 -42.65 66.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.011 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -63.75 -50.86 67.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.982 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -46.58 88.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.591 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.909 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -61.29 -37.4 83.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.962 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.4 -47.9 58.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.443 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 56.3 m -64.7 -33.1 75.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.067 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.456 ' O ' HD12 ' A' ' 172' ' ' ILE . 11.7 m95 -73.61 -50.8 19.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.712 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.808 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -57.15 -46.48 82.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.286 0.565 . . . . 0.0 110.474 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -60.49 -43.09 99.18 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.768 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.82 -40.37 72.48 Favored 'General case' 0 CA--C 1.509 -0.615 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.805 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.765 ' O ' HD13 ' A' ' 176' ' ' ILE . 11.8 mt -60.95 -23.73 30.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.561 ' N ' HG11 ' A' ' 130' ' ' VAL . 17.7 tt0 -78.87 -40.69 31.78 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.481 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.5 -46.18 84.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.43 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.07 -39.01 89.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.023 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.765 HD13 ' O ' ' A' ' 172' ' ' ILE . 1.2 mp -60.07 -36.05 65.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.592 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.46 -179.914 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo . . . . . 0 C--O 1.231 0.154 0 CA-C-O 120.771 0.238 . . . . 0.0 112.386 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -85.41 140.91 30.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.634 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.727 HG22 ' HA ' ' A' ' 33' ' ' SER . 70.4 p -137.24 147.28 45.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.849 0.357 . . . . 0.0 111.191 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -152.55 123.16 1.41 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.356 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 35.0 mt -56.39 102.87 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.829 0.347 . . . . 0.0 111.03 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.872 HD13 HD22 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -112.63 151.65 29.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.716 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -95.23 146.58 24.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.873 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.447 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 14.8 tp -125.03 142.94 51.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.45 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.481 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 19.1 ttp180 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.576 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.481 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.8 m95 . . . . . 0 N--CA 1.462 0.132 0 CA-C-O 120.8 0.333 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -97.97 178.65 5.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.983 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.4 HH11 ' HB1' ' A' ' 44' ' ' ALA . 2.0 tmm_? -105.94 129.95 53.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.845 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.733 HG12 ' HA ' ' A' ' 43' ' ' PRO . 32.6 m -144.46 123.51 6.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.358 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.5 tp -69.72 120.96 16.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.503 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 1.009 HD12 HG13 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -88.12 109.2 19.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.962 -179.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.727 ' HA ' HG22 ' A' ' 9' ' ' THR . 44.1 t -85.01 84.43 7.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.688 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.673 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 4.1 tp -78.74 125.9 30.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.306 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -129.95 141.65 50.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.928 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -63.03 -14.8 52.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.52 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -101.8 -19.89 15.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.108 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.518 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -173.5 172.08 3.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.878 0.37 . . . . 0.0 111.068 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.451 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -121.66 107.86 12.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.809 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -113.69 141.4 47.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.155 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 1.009 HG13 HD12 ' A' ' 32' ' ' LEU . 2.5 t -118.41 152.92 20.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.012 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.4 t -149.05 149.93 31.02 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.541 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.733 ' HA ' HG12 ' A' ' 30' ' ' VAL . 60.4 Cg_endo -72.69 47.5 1.19 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.582 2.188 . . . . 0.0 112.838 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.4 ' HB1' HH11 ' A' ' 29' ' ' ARG . . . . . . . . 0 C--N 1.333 -0.134 0 CA-C-O 120.9 0.381 . . . . 0.0 111.408 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.795 0.331 . . . . 0.0 110.995 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.506 ' HE2' HG12 ' A' ' 155' ' ' VAL . 6.3 mttp -131.79 82.99 2.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.009 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -82.49 150.87 26.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.961 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.497 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 18.7 t -150.37 159.34 4.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.022 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.499 ' O ' HD22 ' A' ' 125' ' ' LEU . 0.7 OUTLIER -82.2 171.54 14.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.048 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.518 HD23 ' HA ' ' A' ' 38' ' ' ALA . 0.7 OUTLIER -134.63 31.54 3.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.825 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.82 41.91 0.94 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.909 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.5 ttm 178.89 -36.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.939 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.12 -165.96 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.251 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.479 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.1 OUTLIER -168.61 137.76 2.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.66 -179.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.623 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -110.25 158.89 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.314 0.578 . . . . 0.0 111.484 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.3 m -163.67 151.43 12.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.473 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 11.8 ptt-85 -123.57 91.76 3.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.879 0.371 . . . . 0.0 111.171 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.703 179.653 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.802 0.334 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.565 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.4 OUTLIER -76.29 105.07 7.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.891 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . 0.425 ' HG3' ' CZ ' ' A' ' 156' ' ' PHE . 0.1 OUTLIER -111.0 130.66 55.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.629 HD11 ' CD1' ' A' ' 172' ' ' ILE . 24.5 mt -129.98 115.63 34.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.075 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 2.9 m -95.2 136.7 35.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.953 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.574 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -116.83 148.58 41.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.175 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.59 30.55 1.98 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.357 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.27 44.51 1.68 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.114 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 118.84 22.2 3.66 Favored Glycine 0 N--CA 1.452 -0.282 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.107 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 58.89 62.05 1.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.123 0.487 . . . . 0.0 110.818 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.574 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 1.2 m-20 -90.63 162.27 15.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.882 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.21 94.21 0.81 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.069 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.506 HG12 ' HE2' ' A' ' 121' ' ' LYS . 32.9 m -87.07 120.23 36.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.328 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.425 ' CZ ' ' HG3' ' A' ' 145' ' ' GLU . 0.3 OUTLIER -104.18 90.03 3.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.75 179.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.482 ' CB ' HD22 ' A' ' 12' ' ' LEU . 1.2 mt -102.75 168.96 8.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.961 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -137.44 103.35 5.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.838 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 1.054 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -57.53 173.49 0.27 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.5 tttp -79.86 -71.41 0.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.989 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -85.08 170.89 12.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.873 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -81.04 -35.56 31.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.948 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -73.33 -40.14 64.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.953 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.11 -41.4 90.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.43 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 1.054 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -64.76 -42.97 94.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.767 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.9 mtt180 -70.43 -43.97 68.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.225 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -34.53 77.84 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.327 0.584 . . . . 0.0 109.502 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.673 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -68.68 -59.83 2.84 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.595 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.565 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -47.13 -57.61 4.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.161 0.505 . . . . 0.0 110.881 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.46 -39.0 58.97 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.438 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -67.66 -41.61 83.51 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.152 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.927 HG22 HD12 ' A' ' 176' ' ' ILE . 12.7 mt -62.0 -23.29 31.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 177.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.623 ' N ' HG11 ' A' ' 130' ' ' VAL . 7.0 tt0 -81.17 -28.55 34.95 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.265 179.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.92 -45.12 75.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.375 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . 0.441 ' HB2' HD11 ' A' ' 125' ' ' LEU . 18.7 mt-30 -74.87 -34.44 62.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.188 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.927 HD12 HG22 ' A' ' 172' ' ' ILE . 82.8 mt -85.77 -7.36 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.33 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.362 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.515 179.916 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo . . . . . 0 C--O 1.231 0.146 0 CA-C-O 120.847 0.27 . . . . 0.0 112.272 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -84.15 152.53 24.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.943 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.756 HG22 ' HA ' ' A' ' 33' ' ' SER . 70.7 p -142.55 142.91 32.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.95 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -150.75 132.0 3.75 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.415 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.71 HD22 ' HD3' ' A' ' 29' ' ' ARG . 11.4 mt -64.84 119.45 10.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.871 0.367 . . . . 0.0 111.04 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 157' ' ' LEU . 0.1 OUTLIER -134.33 158.8 42.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.787 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.63 ' O ' HD23 ' A' ' 157' ' ' LEU . 1.4 mm-40 -92.5 157.75 16.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.969 0.414 . . . . 0.0 110.985 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.4 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 14.3 tp -134.81 130.29 35.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.659 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.488 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 12.9 ttp180 . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.655 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.488 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.7 m95 . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.653 0.263 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -169.28 166.78 10.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.875 0.369 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.71 ' HD3' HD22 ' A' ' 11' ' ' LEU . 7.6 tmm_? -90.81 130.5 36.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.853 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.713 HG12 ' HA ' ' A' ' 43' ' ' PRO . 34.6 m -149.93 125.13 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.367 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 tp -69.8 135.1 49.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.625 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.552 ' HG ' HG22 ' A' ' 41' ' ' VAL . 1.3 mp -103.93 113.97 27.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.964 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.756 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.9 OUTLIER -86.71 81.14 8.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.766 179.861 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.63 HD12 HD21 ' A' ' 39' ' ' LEU . 3.6 tp -73.7 117.08 15.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.105 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.434 ' O ' HD22 ' A' ' 125' ' ' LEU . . . -121.97 138.95 54.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.964 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.88 -23.9 47.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.222 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.33 -31.93 22.74 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.975 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.428 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -172.67 174.22 3.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.205 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.63 HD21 HD12 ' A' ' 34' ' ' LEU . 1.2 mt -111.26 115.32 29.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.864 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 63.9 m -120.27 130.74 54.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.841 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.641 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 14.7 t -111.86 159.34 11.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.169 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.473 ' N ' HG12 ' A' ' 41' ' ' VAL . 6.0 t -155.65 153.34 26.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.495 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.713 ' HA ' HG12 ' A' ' 30' ' ' VAL . 13.7 Cg_exo -69.41 50.68 0.73 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.736 2.291 . . . . 0.0 112.695 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.143 0 CA-C-O 120.875 0.369 . . . . 0.0 111.438 179.893 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.641 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 C--O 1.23 0.05 0 CA-C-O 120.814 0.34 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.32 159.74 15.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.802 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -147.67 135.28 20.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.881 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.756 HG13 ' HB2' ' A' ' 148' ' ' ALA . 19.7 t -139.68 140.15 37.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.135 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.01 135.74 37.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.832 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.434 HD22 ' O ' ' A' ' 35' ' ' ALA . 3.2 mp -99.19 31.49 3.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.864 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -139.41 38.12 2.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.739 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.737 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 2.3 mtt 179.27 -35.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.063 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.8 -165.97 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.322 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -170.04 113.67 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.665 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.576 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.0 p -88.14 158.8 3.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.322 0.582 . . . . 0.0 111.439 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 2.6 m -164.65 149.78 9.84 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.801 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 7.0 ptt85 -126.67 104.04 7.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.012 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.753 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.458 -0.055 0 CA-C-O 120.88 0.371 . . . . 0.0 110.949 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.469 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.8 OUTLIER -82.83 138.1 34.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.949 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . 0.416 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.0 OUTLIER -153.66 139.91 18.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.82 179.952 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 24.9 mt -134.1 125.1 47.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.241 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.47 126.18 49.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.78 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.857 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -102.78 145.53 29.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.361 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.737 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -96.75 30.65 2.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.171 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -118.61 46.07 1.91 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.38 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.39 23.11 2.69 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.356 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.43 60.66 2.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.126 0.489 . . . . 0.0 110.94 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.857 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 0.6 OUTLIER -90.16 160.65 16.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.9 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.23 94.03 0.8 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.078 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 6.9 m -89.48 112.67 24.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.246 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.416 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 15.6 m-85 -97.2 115.99 28.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.731 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.63 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.4 mt -125.66 165.61 18.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.078 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.459 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.1 OUTLIER -140.43 96.81 3.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.748 179.863 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.951 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -57.33 162.88 2.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.203 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.98 -32.23 17.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.924 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -98.13 164.27 12.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.822 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -88.65 -55.8 3.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.91 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.81 85.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.159 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 1.8 t -63.97 -48.16 77.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.79 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.951 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -60.12 -38.61 83.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.011 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 74.3 mtp180 -71.12 -47.33 58.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.436 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.06 -28.4 69.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.176 179.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.6 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -72.44 -52.07 17.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.908 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.469 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -56.9 -47.62 80.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.304 0.573 . . . . 0.0 110.53 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.96 -43.12 97.04 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.64 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.95 -40.72 78.76 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.997 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.795 HG22 HD12 ' A' ' 176' ' ' ILE . 19.1 mt -60.21 -24.63 31.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.576 ' N ' HG11 ' A' ' 130' ' ' VAL . 30.6 tt0 -83.84 -27.0 29.03 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.324 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.56 -47.98 68.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.141 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -69.96 -42.09 73.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.86 179.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.795 HD12 HG22 ' A' ' 172' ' ' ILE . 75.9 mt -77.57 -8.94 12.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.36 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.361 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.393 179.847 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo . . . . . 0 C--O 1.23 0.122 0 CA-C-O 120.84 0.267 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.647 ' CG ' HD23 ' A' ' 34' ' ' LEU . 4.4 ptt180 -101.25 139.18 37.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.952 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.628 HG22 ' HA ' ' A' ' 33' ' ' SER . 14.0 p -129.36 167.98 16.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.02 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -167.05 132.75 2.7 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.48 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.5 103.22 0.63 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.762 0.315 . . . . 0.0 110.895 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -120.19 146.69 45.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.811 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.492 ' O ' HD23 ' A' ' 157' ' ' LEU . 4.1 mm-40 -70.64 169.84 13.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.922 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.422 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 37.6 tp -157.57 130.42 7.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.697 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.483 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.635 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.483 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 17.1 m95 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.726 0.298 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -178.09 168.45 1.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.926 0.393 . . . . 0.0 110.844 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -95.09 129.02 42.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.866 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 27.7 m -136.65 138.39 46.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.177 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 17.4 tp -74.33 123.44 24.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.658 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.776 HD12 HG13 ' A' ' 41' ' ' VAL . 0.4 OUTLIER -98.04 114.49 26.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.108 -179.833 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.628 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.9 OUTLIER -94.47 85.74 4.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.575 179.657 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.732 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 2.5 tp -84.93 103.7 14.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.136 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.639 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -91.21 155.96 18.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.706 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -57.43 -16.73 10.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.816 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.06 28.95 1.1 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.432 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.69 ' CA ' HD23 ' A' ' 125' ' ' LEU . . . 179.55 114.75 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.858 0.361 . . . . 0.0 111.514 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.543 HD13 HD12 ' A' ' 34' ' ' LEU . 17.2 tp -95.92 82.44 3.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.397 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.489 HG21 ' CE1' ' A' ' 122' ' ' HIS . 27.6 m -92.49 114.19 26.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.204 -179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.776 HG13 HD12 ' A' ' 32' ' ' LEU . 8.0 t -83.41 157.35 3.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.675 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.411 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -159.9 163.09 23.42 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.906 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.35 147.41 59.0 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.534 2.156 . . . . 0.0 112.133 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.984 179.905 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.488 ' HB3' ' NE2' ' A' ' 122' ' ' HIS . . . . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.845 0.355 . . . . 0.0 111.224 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.431 ' HB2' HG23 ' A' ' 41' ' ' VAL . 2.0 mtpp -110.41 74.53 0.88 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.049 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.489 ' CE1' HG21 ' A' ' 40' ' ' THR . 19.6 m-70 -73.05 102.7 3.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.975 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.763 HG13 ' HB2' ' A' ' 148' ' ' ALA . 24.7 t -99.94 115.65 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.965 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 72.1 p -59.74 137.44 58.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.848 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.69 HD23 ' CA ' ' A' ' 38' ' ' ALA . 4.0 mm? -98.64 53.96 1.03 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.807 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 27.1 mttt -164.45 37.3 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.006 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.713 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -178.51 -39.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.38 . . . . 0.0 110.949 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.15 -169.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.149 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.675 ' HA ' HG21 ' A' ' 176' ' ' ILE . 13.6 t80 -170.11 123.48 0.71 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.495 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.569 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.5 p -94.66 157.65 3.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.492 0.663 . . . . 0.0 111.615 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.479 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -170.31 127.67 0.83 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.696 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 18.3 ptt-85 -83.26 96.49 8.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.947 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 30.3 mtt180 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.034 -179.751 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 . . . . . 0 N--CA 1.456 -0.153 0 CA-C-O 120.842 0.353 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.544 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 2.0 mt -69.94 94.02 0.82 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.97 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -99.9 123.67 44.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.78 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.484 HD11 HD13 ' A' ' 172' ' ' ILE . 22.5 mt -128.81 120.8 53.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.212 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -101.91 129.74 48.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.775 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.763 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -110.98 146.46 36.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.192 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.713 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.1 30.84 2.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.283 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -114.95 44.92 1.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.062 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.93 20.93 3.3 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.692 -0.686 . . . . 0.0 112.249 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.411 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 4.5 mm-40 58.69 61.33 2.23 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.066 0.46 . . . . 0.0 110.949 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.604 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.4 m-20 -92.85 157.96 16.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.682 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -161.15 92.78 0.93 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.225 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.8 m -84.49 127.17 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.032 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -109.21 88.72 2.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.742 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.492 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.5 mt -95.95 153.57 17.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.901 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.457 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER -127.83 94.02 3.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.841 -179.893 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.992 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -58.24 143.53 44.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.123 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.07 -32.95 51.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.816 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.12 168.6 10.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.848 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -88.72 -61.3 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.878 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -59.7 -31.96 70.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.075 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -49.82 70.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.745 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.992 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -60.44 -41.87 94.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.183 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -71.33 -40.38 70.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.545 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 94.4 p -68.59 -33.89 74.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.097 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.732 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -74.28 -49.1 24.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.839 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.544 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -58.57 -49.76 76.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.328 0.585 . . . . 0.0 110.278 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.65 -42.02 96.0 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.425 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.18 -40.68 77.96 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.77 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.718 HG22 HD12 ' A' ' 176' ' ' ILE . 11.2 mt -60.33 -24.43 30.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.569 ' N ' HG11 ' A' ' 130' ' ' VAL . 6.3 tp60 -81.43 -29.88 33.7 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.008 -0.997 . . . . 0.0 110.069 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.79 -49.8 71.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.119 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.24 -42.14 84.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.713 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.718 HD12 HG22 ' A' ' 172' ' ' ILE . 80.5 mt -76.83 -5.55 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.42 179.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.359 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.454 179.866 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 N--CA 1.464 -0.218 0 CA-C-O 120.805 0.252 . . . . 0.0 112.366 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.4 ttt85 -72.37 141.95 48.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.833 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 77.4 p -143.34 165.13 28.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.978 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 173.8 135.52 2.03 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.421 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.8 mt -68.62 122.36 18.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 0.0 110.935 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.494 HD22 ' HB3' ' A' ' 157' ' ' LEU . 0.1 OUTLIER -131.91 158.41 41.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.723 179.797 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.81 150.95 20.82 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.071 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.418 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 7.3 tp -134.29 137.54 44.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.577 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.532 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.82 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.532 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 24.7 m95 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.733 0.302 . . . . 0.0 110.902 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.16 152.54 24.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.065 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.97 135.01 37.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.982 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.644 HG12 ' HA ' ' A' ' 43' ' ' PRO . 33.0 m -148.25 125.75 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.26 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.8 tp -69.8 135.94 50.26 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.596 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.61 HD12 HG13 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -104.53 142.0 35.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.747 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.0 m -123.12 94.53 4.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.884 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.507 HD11 HG13 ' A' ' 172' ' ' ILE . 0.4 OUTLIER -85.55 96.81 9.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.815 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -107.63 137.8 45.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.951 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -57.1 -23.0 43.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.081 0.467 . . . . 0.0 111.226 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 89.9 m-20 -85.11 -31.1 23.52 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.722 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -175.79 168.76 3.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.021 0.439 . . . . 0.0 111.315 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.535 ' C ' HD13 ' A' ' 39' ' ' LEU . 3.2 tm? -111.0 108.77 18.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.417 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.561 HG23 ' CD2' ' A' ' 122' ' ' HIS . 8.3 m -114.2 139.23 49.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.254 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.61 HG13 HD12 ' A' ' 32' ' ' LEU . 16.8 t -117.46 159.69 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.881 179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.472 ' N ' HG12 ' A' ' 41' ' ' VAL . 3.1 t -156.34 152.55 23.36 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.708 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.644 ' HA ' HG12 ' A' ' 30' ' ' VAL . 60.0 Cg_endo -72.08 47.71 1.06 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.485 2.123 . . . . 0.0 112.485 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.213 0 CA-C-O 121.118 0.485 . . . . 0.0 111.11 -179.771 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.074 0 CA-C-O 120.876 0.37 . . . . 0.0 111.082 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.473 ' HE2' HG13 ' A' ' 155' ' ' VAL . 0.9 OUTLIER -129.3 91.18 3.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.91 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.561 ' CD2' HG23 ' A' ' 40' ' ' THR . 20.4 m80 -80.22 143.18 33.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.928 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.409 ' CG1' ' HB2' ' A' ' 148' ' ' ALA . 20.3 t -142.22 140.48 29.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.122 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.706 ' C ' HD22 ' A' ' 125' ' ' LEU . 1.4 m -76.74 158.52 30.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.722 HD23 ' HA ' ' A' ' 38' ' ' ALA . 3.7 mm? -123.18 43.66 2.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.939 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -142.82 35.73 1.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.846 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.779 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER 179.25 -36.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.954 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.85 -173.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.316 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.576 ' HA ' HG21 ' A' ' 176' ' ' ILE . 17.8 t80 -170.04 128.2 0.89 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.682 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.626 HG12 HD12 ' A' ' 176' ' ' ILE . 2.4 p -105.52 159.52 5.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.321 0.581 . . . . 0.0 111.493 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -165.46 134.22 3.27 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.78 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -99.59 91.88 5.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.098 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.619 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.433 ' CZ ' ' HB3' ' A' ' 156' ' ' PHE . 5.1 t80 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.84 0.352 . . . . 0.0 110.991 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.664 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.7 OUTLIER -95.6 114.63 26.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.852 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . 0.412 ' HG3' ' CE1' ' A' ' 156' ' ' PHE . 43.3 tt0 -120.78 128.71 53.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.994 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 1.122 HD13 HG21 ' A' ' 172' ' ' ILE . 19.6 mt -132.3 110.03 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.168 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.27 122.54 40.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.806 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.605 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -105.45 146.57 29.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.24 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.779 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.31 30.47 2.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.261 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -115.06 44.95 1.7 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.076 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.54 23.45 2.58 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.17 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.409 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 6.2 mm-40 56.64 59.23 3.66 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.048 0.451 . . . . 0.0 110.978 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.605 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 6.6 m-20 -90.58 160.36 15.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.797 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -165.98 95.45 0.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.159 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.473 HG13 ' HE2' ' A' ' 121' ' ' LYS . 11.1 m -90.1 128.46 42.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.167 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.433 ' HB3' ' CZ ' ' A' ' 143' ' ' TYR . 20.9 m-85 -115.93 92.42 3.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.67 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.494 ' HB3' HD22 ' A' ' 12' ' ' LEU . 1.5 mt -98.61 168.18 10.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.128 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.467 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER -134.14 93.47 3.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.571 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 1.071 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.28 168.96 0.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.339 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -84.37 -67.27 0.81 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.959 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -90.28 164.57 14.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.943 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.99 -43.24 79.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.837 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -67.74 -32.54 73.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.077 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 62.2 m -66.28 -50.07 64.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.797 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 1.071 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -62.22 -37.51 85.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.911 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 15.0 ttt180 -72.74 -43.86 62.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.387 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.3 t -65.59 -32.9 74.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.945 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.425 ' CZ3' ' HB2' ' A' ' 34' ' ' LEU . 8.5 m95 -74.16 -53.15 10.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.691 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.664 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -58.08 -50.78 72.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.339 0.59 . . . . 0.0 110.388 179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.74 -38.38 91.84 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.554 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -71.29 -40.21 71.01 Favored 'General case' 0 CA--C 1.511 -0.545 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.999 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 1.122 HG21 HD13 ' A' ' 146' ' ' ILE . 8.4 mt -62.54 -22.7 30.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.572 ' N ' HG11 ' A' ' 130' ' ' VAL . 26.5 tt0 -77.35 -40.47 43.9 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.434 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.36 -37.53 87.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.471 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . 0.426 ' C ' HD12 ' A' ' 125' ' ' LEU . 4.7 mp0 -76.81 -33.08 58.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.187 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.626 HD12 HG12 ' A' ' 130' ' ' VAL . 48.1 mt -73.75 -28.92 25.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.809 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.37 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.781 179.881 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo . . . . . 0 C--O 1.232 0.195 0 CA-C-O 120.718 0.216 . . . . 0.0 112.234 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.89 152.34 18.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.761 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.665 HG22 ' HA ' ' A' ' 33' ' ' SER . 6.9 p -146.13 158.07 43.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.997 0.427 . . . . 0.0 111.219 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -156.11 135.28 4.46 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.266 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 11' ' ' LEU . 12.9 mt -62.92 106.69 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.778 0.323 . . . . 0.0 110.911 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -117.03 170.07 8.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.865 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.613 ' O ' HD23 ' A' ' 157' ' ' LEU . 9.0 mt-10 -107.68 162.68 13.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.016 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.6 tp -137.1 129.66 30.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.553 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.482 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 37.9 ttp180 . . . . . 0 C--N 1.329 -0.302 0 CA-C-O 120.874 0.369 . . . . 0.0 110.717 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.482 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 29.0 m95 . . . . . 0 N--CA 1.461 0.1 0 CA-C-O 120.924 0.392 . . . . 0.0 111.17 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -148.95 -166.72 2.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.882 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.0 ttp-105 -124.93 110.76 14.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.989 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.73 HG12 ' HA ' ' A' ' 43' ' ' PRO . 34.6 m -125.35 127.53 72.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.159 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.8 tp -76.04 115.53 15.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.409 HD13 HD22 ' A' ' 157' ' ' LEU . 0.4 OUTLIER -84.62 121.58 27.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.904 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.665 ' HA ' HG22 ' A' ' 9' ' ' THR . 17.7 m -103.61 86.84 2.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.647 HD13 HD13 ' A' ' 172' ' ' ILE . 14.7 tp -78.36 113.35 16.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.819 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -106.39 148.93 27.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.915 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -64.88 -11.71 40.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.712 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -134.84 16.6 3.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.314 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.633 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . 179.28 160.04 0.7 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.85 0.357 . . . . 0.0 111.265 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.65 ' HB2' HD21 ' A' ' 125' ' ' LEU . 66.5 tp -124.23 88.71 2.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.557 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.701 HG23 ' O ' ' A' ' 121' ' ' LYS . 79.4 m -94.29 145.31 24.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.158 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.497 HG12 ' N ' ' A' ' 42' ' ' SER . 21.2 t -125.65 160.21 32.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.019 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.497 ' N ' HG12 ' A' ' 41' ' ' VAL . 84.5 p -151.9 152.13 29.4 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.539 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.73 ' HA ' HG12 ' A' ' 30' ' ' VAL . 95.7 Cg_endo -78.93 37.68 0.68 Allowed 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.666 2.244 . . . . 0.0 112.852 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.221 0 CA-C-O 121.076 0.465 . . . . 0.0 111.325 -179.986 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.414 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.84 0.352 . . . . 0.0 111.047 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.701 ' O ' HG23 ' A' ' 40' ' ' THR . 0.8 OUTLIER -88.44 160.31 17.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.914 179.923 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.405 ' CE1' ' O ' ' A' ' 120' ' ' ALA . 16.9 m80 -152.27 113.01 4.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.77 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.449 HG11 ' HB2' ' A' ' 148' ' ' ALA . 21.5 t -119.94 133.63 66.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.144 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 13.1 t -75.46 147.11 40.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.812 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.912 HD13 ' HB3' ' A' ' 175' ' ' GLN . 18.1 mt -104.2 38.08 1.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.043 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -128.59 34.29 4.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.792 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.798 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER 179.58 -35.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.009 179.989 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.56 -173.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.347 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -170.07 111.29 0.43 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.491 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.618 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -87.45 159.18 3.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.272 0.558 . . . . 0.0 111.406 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.466 ' N ' HG22 ' A' ' 130' ' ' VAL . 97.8 p -162.05 149.14 13.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.708 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.443 ' HD3' ' HB3' ' A' ' 169' ' ' ALA . 27.9 ptt85 -118.69 95.79 4.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.965 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.847 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.805 0.336 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.776 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.9 OUTLIER -89.68 98.24 11.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.77 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -108.39 137.31 46.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.895 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.503 HD13 HG21 ' A' ' 172' ' ' ILE . 23.3 mt -137.27 108.81 6.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.144 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.3 m -92.51 135.37 34.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.864 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -113.12 144.9 41.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.187 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.798 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -94.55 30.9 1.88 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.304 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -121.44 48.17 1.72 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.129 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.28 18.77 3.68 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.375 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.417 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 4.8 mm-40 58.64 61.67 2.15 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.096 0.474 . . . . 0.0 111.021 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.864 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 1.2 m-20 -89.85 163.81 14.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.8 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.85 96.47 0.44 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.068 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.3 m -97.63 121.76 48.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.169 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 156' ' ' PHE . 0.5 OUTLIER -113.05 106.29 14.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.791 179.802 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.613 HD23 ' O ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -111.92 166.23 11.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.067 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.427 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -129.15 109.96 11.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.868 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.91 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -68.83 158.76 33.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.076 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -31.5 24.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.95 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -109.32 160.54 16.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.944 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -74.16 -61.78 1.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -58.99 -27.89 65.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.172 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 45.2 t -66.64 -48.43 69.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.699 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.91 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -62.12 -42.51 99.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.973 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 40.7 mtt180 -71.27 -40.81 70.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.449 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 32.6 t -67.66 -34.38 76.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.059 0.457 . . . . 0.0 109.939 179.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.445 ' O ' HG12 ' A' ' 172' ' ' ILE . 12.9 m95 -72.5 -52.49 15.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.67 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.776 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -56.53 -45.98 80.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.171 0.51 . . . . 0.0 110.465 179.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.61 -43.98 95.85 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.518 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.36 -40.8 77.26 Favored 'General case' 0 CA--C 1.511 -0.544 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.611 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.768 HG22 HD12 ' A' ' 176' ' ' ILE . 12.9 mm -58.67 -24.81 26.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.618 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -84.12 -28.62 27.36 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.2 179.216 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.42 -40.87 77.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.247 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . 0.912 ' HB3' HD13 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -75.14 -41.27 58.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.004 179.156 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.768 HD12 HG22 ' A' ' 172' ' ' ILE . 54.0 mt -79.9 -10.29 12.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.268 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.448 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.367 179.8 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.793 0.247 . . . . 0.0 112.271 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.74 100.31 6.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.869 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.468 HG22 ' HA ' ' A' ' 33' ' ' SER . 20.7 p -100.65 167.8 10.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.986 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.81 132.05 2.2 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.371 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -59.91 123.46 17.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.864 0.364 . . . . 0.0 110.87 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.607 HD21 ' CD1' ' A' ' 144' ' ' LEU . 0.1 OUTLIER -136.17 170.13 16.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.801 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.571 ' O ' HD23 ' A' ' 157' ' ' LEU . 8.1 mt-10 -104.29 152.45 22.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.061 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.519 ' HB2' HG21 ' A' ' 30' ' ' VAL . 26.6 tp -138.71 137.15 36.52 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.564 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.479 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 7.1 ptt180 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.763 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.479 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 18.9 m95 . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.72 0.295 . . . . 0.0 111.026 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -96.06 165.63 12.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.887 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.7 ttp180 -84.68 147.13 27.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.008 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.519 HG21 ' HB2' ' A' ' 14' ' ' LEU . 35.5 m -155.1 144.2 12.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.983 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.9 tp -100.48 124.68 46.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.573 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.542 HD22 HD13 ' A' ' 12' ' ' LEU . 3.5 mp -89.52 151.27 22.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.915 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.468 ' HA ' HG22 ' A' ' 9' ' ' THR . 10.3 t -131.39 98.42 4.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.596 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.735 ' HA ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -86.89 95.73 9.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.025 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -99.37 142.69 30.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.931 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -59.97 -17.62 39.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.352 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -93.48 -27.87 16.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.974 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.486 ' HB1' ' O ' ' A' ' 123' ' ' VAL . . . -179.94 -170.84 0.16 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.207 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 34' ' ' LEU . 8.2 tp -115.47 154.79 28.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.823 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.615 HG23 ' CD2' ' A' ' 122' ' ' HIS . 91.3 m -155.15 140.9 18.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.07 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.422 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 3.9 t -127.61 156.18 39.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.14 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -153.52 167.43 13.59 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.495 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -79.19 45.54 1.96 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.534 2.156 . . . . 0.0 112.749 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.181 0 CA-C-O 121.01 0.433 . . . . 0.0 111.159 179.996 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.422 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.783 0.325 . . . . 0.0 111.17 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.4 ' HB2' ' HB ' ' A' ' 41' ' ' VAL . 12.3 mtmm -104.48 90.48 3.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.96 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.615 ' CD2' HG23 ' A' ' 40' ' ' THR . 12.6 m-70 -93.03 116.3 28.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.935 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.636 HG13 ' HB2' ' A' ' 148' ' ' ALA . 4.5 t -90.93 115.97 31.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.893 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 21.2 m -57.05 -28.01 62.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.259 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.3 mp 63.97 -166.94 0.22 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.809 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.1 tttt 63.14 33.44 14.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.815 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.511 ' HG3' ' HB3' ' A' ' 149' ' ' ALA . 2.3 ptt? 176.76 -35.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.79 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.407 ' HB2' ' HA ' ' A' ' 148' ' ' ALA . . . -53.6 -175.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.376 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.476 ' CE2' ' CB ' ' A' ' 147' ' ' CYS . 1.0 OUTLIER -162.07 113.96 1.69 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.75 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.611 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.3 p -89.31 159.9 2.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.381 0.61 . . . . 0.0 111.414 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.488 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.4 OUTLIER -165.98 138.28 3.97 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.866 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.02 117.23 29.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.946 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . 0.444 ' CB ' ' CZ ' ' A' ' 143' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.839 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.444 ' CZ ' ' CB ' ' A' ' 133' ' ' ARG . 24.5 p90 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.817 0.341 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.937 HD23 ' HB2' ' A' ' 169' ' ' ALA . 2.7 mt -92.17 105.57 17.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . 0.441 ' HG3' ' CZ ' ' A' ' 156' ' ' PHE . 0.5 OUTLIER -100.29 115.31 29.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.938 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.978 HD13 HG21 ' A' ' 172' ' ' ILE . 28.1 mt -121.1 131.95 71.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.021 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.476 ' CB ' ' CE2' ' A' ' 129' ' ' TYR . 0.8 OUTLIER -120.47 123.41 42.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.972 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.636 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -106.22 147.34 29.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.083 0.468 . . . . 0.0 111.175 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.511 ' HB3' ' HG3' ' A' ' 127' ' ' MET . . . -95.47 30.38 2.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.303 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -112.68 43.65 1.62 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.072 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 122.39 23.84 2.29 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.106 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.417 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 5.9 mm-40 56.71 59.42 3.55 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 120.943 0.401 . . . . 0.0 110.957 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.432 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 3.0 m-20 -89.03 149.59 23.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.855 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.22 89.1 1.41 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.996 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 4.7 m -87.12 122.35 38.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.315 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.441 ' CZ ' ' HG3' ' A' ' 145' ' ' GLU . 7.9 m-85 -107.16 97.99 7.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.604 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.571 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.4 mt -104.39 162.0 13.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.183 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.454 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -132.97 87.63 2.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.636 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 1.094 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -49.97 172.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.515 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.2 tttm -78.56 -67.13 0.77 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.984 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -98.07 179.27 4.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.927 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.88 -40.87 21.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.887 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.97 94.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.071 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 1.4 m -66.09 -48.04 72.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.575 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 1.094 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -64.54 -34.98 79.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.775 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.11 -45.52 56.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.305 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 53.8 p -63.63 -36.94 85.47 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.594 ' CZ3' HD12 ' A' ' 34' ' ' LEU . 10.2 m95 -69.23 -57.08 5.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.463 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.937 ' HB2' HD23 ' A' ' 144' ' ' LEU . . . -49.5 -57.81 6.35 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.321 0.581 . . . . 0.0 110.715 179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.42 -38.11 56.99 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.564 -0.743 . . . . 0.0 112.619 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.63 -40.59 76.46 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 120.675 -0.41 . . . . 0.0 111.04 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.978 HG21 HD13 ' A' ' 146' ' ' ILE . 39.0 mm -60.94 -23.88 31.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 177.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.611 ' N ' HG11 ' A' ' 130' ' ' VAL . 2.2 tt0 -78.01 -37.53 46.89 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.494 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -60.38 -46.83 88.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.614 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 89.2 mm-40 -72.02 -34.2 68.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.188 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.614 ' CD1' HG22 ' A' ' 172' ' ' ILE . 41.9 mt -70.63 -29.24 37.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.688 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.761 179.876 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.852 0.272 . . . . 0.0 112.367 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -80.28 150.93 29.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.832 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 28.0 p -152.61 162.86 40.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.915 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 172.68 133.61 1.68 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.431 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.54 HD22 ' CD ' ' A' ' 29' ' ' ARG . 17.4 mt -63.09 120.1 10.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.783 0.325 . . . . 0.0 110.991 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.967 HD13 HD22 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -127.68 170.12 13.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.706 ' O ' HD23 ' A' ' 157' ' ' LEU . 3.0 tt0 -103.36 166.55 10.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.976 0.417 . . . . 0.0 111.122 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 26.1 tp -148.45 126.71 12.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.523 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.482 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 4.4 ptt180 . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.909 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.482 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 31.0 m95 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.809 0.338 . . . . 0.0 110.967 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -153.86 173.62 15.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.937 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.54 ' CD ' HD22 ' A' ' 11' ' ' LEU . 0.8 OUTLIER -102.17 121.09 41.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.098 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.806 HG12 ' HA ' ' A' ' 43' ' ' PRO . 26.9 m -139.75 121.96 16.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.067 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.01 136.17 50.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.632 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.967 HD22 HD13 ' A' ' 12' ' ' LEU . 1.8 mp -102.57 159.76 15.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 t -142.11 92.06 2.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.679 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -79.39 97.38 6.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.858 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -101.01 137.49 39.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.062 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -56.82 -23.09 41.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.115 0.483 . . . . 0.0 111.229 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.523 ' OD1' ' HB1' ' A' ' 35' ' ' ALA . 6.7 p-10 -86.6 -32.28 20.71 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.778 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.63 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -178.15 175.27 1.25 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.175 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.885 ' HB2' HD13 ' A' ' 125' ' ' LEU . 0.3 OUTLIER -103.18 131.36 50.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.623 179.817 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.693 ' N ' HD13 ' A' ' 39' ' ' LEU . 70.4 m -131.1 128.41 40.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.942 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.569 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 15.9 t -114.93 159.13 14.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.136 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.469 ' N ' HG12 ' A' ' 41' ' ' VAL . 2.6 t -155.64 153.16 25.78 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.552 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.806 ' HA ' HG12 ' A' ' 30' ' ' VAL . 72.3 Cg_endo -74.33 45.13 1.15 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.548 2.165 . . . . 0.0 112.822 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.145 0 CA-C-O 120.916 0.388 . . . . 0.0 111.345 179.919 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.569 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.9 0.381 . . . . 0.0 111.136 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 17.7 mttm -117.76 103.77 10.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.92 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 8.1 m170 -101.56 101.99 12.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.042 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.433 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 2.9 t -90.03 139.43 17.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.868 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.2 p -54.83 -36.98 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.22 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.885 HD13 ' HB2' ' A' ' 39' ' ' LEU . 6.4 tp 62.71 30.71 16.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.003 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -143.85 36.66 1.29 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.41 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.406 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER 177.27 -30.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.8 -179.832 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.438 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -55.3 -166.64 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.23 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.483 ' HA ' HG21 ' A' ' 176' ' ' ILE . 14.7 t80 -165.89 122.39 1.36 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.656 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.559 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.8 p -99.28 159.97 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.399 0.619 . . . . 0.0 111.657 -179.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.498 ' N ' HG22 ' A' ' 130' ' ' VAL . 4.5 p -160.81 154.58 22.42 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.562 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.66 100.14 5.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.905 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.849 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.82 0.343 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.691 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.4 OUTLIER -81.21 153.21 27.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.834 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . 0.414 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.1 tt0 -158.77 137.78 11.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.511 HG12 HG21 ' A' ' 172' ' ' ILE . 4.5 mp -141.65 120.82 10.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.053 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.438 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 16.3 m -100.95 139.58 36.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.851 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -106.7 149.08 27.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.425 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.406 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.73 30.3 2.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.215 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -121.73 48.49 1.69 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.071 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.58 18.81 3.93 Favored Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.123 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.432 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 3.3 mm-40 58.97 61.48 2.13 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.086 0.47 . . . . 0.0 111.005 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.5 165.54 15.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.552 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.96 96.56 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.219 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.8 m -91.85 127.09 44.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.266 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.414 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 0.2 OUTLIER -107.48 117.35 33.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.668 179.787 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.706 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.0 OUTLIER -124.72 161.3 26.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.029 -179.813 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.456 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -127.31 112.77 15.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.842 -179.903 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.959 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -71.05 172.92 8.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.094 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -80.77 -66.47 0.88 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.929 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -103.0 -178.36 3.64 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.886 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -75.84 -49.45 17.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.964 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -60.37 -36.69 78.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.151 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 66.3 m -67.62 -44.21 78.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.761 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.959 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -66.96 -37.9 85.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.809 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -73.68 -41.74 62.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.316 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 3.7 m -65.77 -32.73 74.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.924 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.497 ' CZ3' HD12 ' A' ' 34' ' ' LEU . 11.3 m95 -75.76 -54.88 6.25 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.57 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.691 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -57.44 -47.29 82.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.323 0.583 . . . . 0.0 110.407 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -60.46 -41.72 98.73 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.638 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.7 -40.19 73.0 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.855 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.693 HG22 HD12 ' A' ' 176' ' ' ILE . 17.3 mt -60.88 -24.39 32.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.559 ' N ' HG11 ' A' ' 130' ' ' VAL . 17.8 tt0 -80.61 -31.67 36.56 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.229 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -62.36 -48.83 78.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.241 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -67.89 -40.77 83.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.773 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.693 HD12 HG22 ' A' ' 172' ' ' ILE . 81.9 mt -77.6 -4.77 6.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.414 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.355 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.896 179.844 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.421 ' HB3' ' HB2' ' A' ' 35' ' ' ALA . 36.9 Cg_exo . . . . . 0 C--O 1.23 0.095 0 CA-C-O 120.914 0.298 . . . . 0.0 112.237 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.6 ttt85 -93.49 129.62 39.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.488 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.624 HG22 ' HA ' ' A' ' 33' ' ' SER . 10.6 p -137.59 140.77 41.17 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.929 0.395 . . . . 0.0 111.198 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.18 135.1 6.25 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.367 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 11' ' ' LEU . 11.3 mt -58.64 108.17 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.936 0.398 . . . . 0.0 111.006 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 157' ' ' LEU . 0.0 OUTLIER -118.87 164.79 14.91 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.755 179.859 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -102.96 155.54 18.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.946 0.403 . . . . 0.0 111.019 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 156' ' ' PHE . 5.8 tp -133.96 135.17 43.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.614 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.477 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 31.0 ttp180 . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.803 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.477 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 45.1 m95 . . . . . 0 CA--C 1.529 0.14 0 CA-C-O 120.759 0.314 . . . . 0.0 111.168 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -154.59 -172.42 4.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.945 0.403 . . . . 0.0 111.058 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -109.7 121.84 46.13 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.048 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.686 HG12 ' HA ' ' A' ' 43' ' ' PRO . 30.6 m -140.51 124.28 17.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.094 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tp -69.72 120.86 16.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.567 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.691 HD12 HG13 ' A' ' 41' ' ' VAL . 7.5 tp -89.08 116.35 27.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.017 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.624 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.2 OUTLIER -96.58 89.36 4.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.676 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.707 HD12 ' HG ' ' A' ' 39' ' ' LEU . 1.2 tp -89.15 123.99 33.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.003 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.421 ' HB2' ' HB3' ' A' ' 7' ' ' PRO . . . -134.5 149.21 50.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.027 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.4 -16.87 50.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.46 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -92.32 -27.02 17.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.013 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.424 ' HA ' HD13 ' A' ' 125' ' ' LEU . . . -178.58 176.75 0.97 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.047 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.707 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -124.33 95.6 4.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.844 179.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 60.5 m -102.69 130.24 49.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.984 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.691 HG13 HD12 ' A' ' 32' ' ' LEU . 9.8 t -100.72 157.64 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.06 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.429 ' N ' HG12 ' A' ' 41' ' ' VAL . 15.8 p -147.33 154.15 45.23 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.603 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.686 ' HA ' HG12 ' A' ' 30' ' ' VAL . 71.9 Cg_endo -77.43 40.51 0.85 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.592 2.195 . . . . 0.0 112.779 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.218 0 CA-C-O 121.191 0.52 . . . . 0.0 111.015 -179.973 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.81 0.338 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 12.6 mttm -106.81 81.08 1.52 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.008 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -72.24 93.63 1.49 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.873 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.49 HG13 ' HB2' ' A' ' 148' ' ' ALA . 21.5 t -88.2 111.21 22.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.207 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.29 129.06 38.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.844 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.522 HD23 ' O ' ' A' ' 175' ' ' GLN . 2.3 mp -88.9 -170.02 2.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.031 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.29 38.5 16.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.773 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.42 ' HG2' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -179.88 -38.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.858 179.956 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.73 -169.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.205 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -162.19 115.04 1.74 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.471 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.585 HG22 ' N ' ' A' ' 131' ' ' SER . 7.1 p -91.0 162.42 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.479 0.657 . . . . 0.0 111.793 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.585 ' N ' HG22 ' A' ' 130' ' ' VAL . 1.1 m -165.35 141.41 5.39 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.492 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.593 ' HD3' ' HB3' ' A' ' 169' ' ' ALA . 19.7 ptt85 -107.76 115.31 29.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.953 0.406 . . . . 0.0 111.043 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . 0.466 ' O ' ' N ' ' A' ' 143' ' ' TYR . 2.8 mtp180 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.595 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.466 ' N ' ' O ' ' A' ' 133' ' ' ARG . 19.3 t80 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.816 0.341 . . . . 0.0 110.946 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.11 108.77 12.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.712 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -111.88 144.13 41.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.501 HG12 HG23 ' A' ' 130' ' ' VAL . 19.6 mt -139.1 126.03 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.066 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.8 p -111.65 117.83 33.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.542 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -98.61 146.34 25.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.236 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.42 ' HB3' ' HG2' ' A' ' 127' ' ' MET . . . -96.05 31.68 2.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.237 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -115.33 44.62 1.8 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.33 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.56 24.21 2.42 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.484 -179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.33 60.09 2.76 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.985 0.421 . . . . 0.0 110.969 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.542 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 0.7 OUTLIER -91.7 151.98 20.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.739 179.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -155.05 90.0 1.25 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.247 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 10.4 m -89.21 127.58 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.075 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.518 ' O ' HD12 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -112.78 117.23 31.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.918 179.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.604 ' HB3' HD23 ' A' ' 12' ' ' LEU . 1.1 mp -126.62 168.69 13.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.437 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 1.7 ttp85 -142.32 118.2 10.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.954 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.847 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -78.05 172.67 13.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.037 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.99 -31.79 12.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -106.41 140.17 39.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.926 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -66.37 -42.85 87.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.085 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.88 -46.11 75.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.067 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.47 -49.53 77.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.62 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.847 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -58.25 -38.93 77.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.139 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . 0.405 ' HA ' ' HD3' ' A' ' 132' ' ' ARG . 1.6 ttt-85 -69.7 -47.79 61.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.532 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.64 -30.81 71.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.022 0.439 . . . . 0.0 110.249 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.676 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 6.0 m95 -72.13 -48.95 39.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.972 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.593 ' HB3' ' HD3' ' A' ' 132' ' ' ARG . . . -57.87 -54.55 45.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.283 0.564 . . . . 0.0 110.545 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.64 -36.96 80.98 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.642 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -72.84 -39.57 66.46 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 120.966 0.413 . . . . 0.0 110.615 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.511 HG12 HD13 ' A' ' 34' ' ' LEU . 11.9 mt -61.94 -22.74 29.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.5 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.7 OUTLIER -77.96 -44.77 25.79 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.532 179.644 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.82 -33.94 77.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.591 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . 0.522 ' O ' HD23 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -79.45 -29.84 41.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.981 179.174 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.455 ' CD1' HG22 ' A' ' 172' ' ' ILE . 6.1 mt -68.04 -28.93 42.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.53 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.334 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.685 179.793 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo . . . . . 0 C--O 1.231 0.133 0 CA-C-O 120.846 0.269 . . . . 0.0 112.278 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.609 ' CD ' HD23 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -107.7 153.5 22.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.683 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.777 HG22 ' HA ' ' A' ' 33' ' ' SER . 28.6 p -140.35 161.37 37.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.06 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -161.31 126.49 1.59 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.414 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.683 HD13 ' HE ' ' A' ' 29' ' ' ARG . 67.9 mt -60.32 110.46 1.25 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.744 0.307 . . . . 0.0 110.936 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.435 HD13 HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -121.45 132.54 54.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.87 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.37 149.6 47.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.818 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 58.0 tp -125.51 139.69 53.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.772 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.461 ' HA ' ' CD2' ' A' ' 27' ' ' TRP . 6.1 ttm180 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.445 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.477 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 28.0 m95 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.819 0.342 . . . . 0.0 110.86 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -102.11 -173.35 2.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.972 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.683 ' HE ' HD13 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -112.15 128.03 56.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.897 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.707 HG12 ' HA ' ' A' ' 43' ' ' PRO . 25.5 m -143.62 122.95 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.172 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tp -69.82 137.01 51.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.576 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.547 HD12 HG13 ' A' ' 41' ' ' VAL . 1.8 mp -106.81 109.92 21.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.14 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.777 ' HA ' HG22 ' A' ' 9' ' ' THR . 1.2 m -85.14 88.17 7.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.604 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.968 HD12 HD13 ' A' ' 39' ' ' LEU . 3.0 tp -79.76 131.36 35.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.191 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.59 145.51 38.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.913 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.46 -15.15 48.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.447 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -96.29 -24.02 16.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.046 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.741 ' HB1' ' O ' ' A' ' 123' ' ' VAL . . . -177.42 -178.68 0.78 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 0.0 111.153 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.968 HD13 HD12 ' A' ' 34' ' ' LEU . 30.4 tp -128.32 102.88 6.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.722 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.635 HG23 ' CD2' ' A' ' 122' ' ' HIS . 58.5 m -102.91 136.39 42.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.031 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.547 HG13 HD12 ' A' ' 32' ' ' LEU . 16.7 t -109.25 159.33 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.101 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.478 ' N ' HG12 ' A' ' 41' ' ' VAL . 11.9 t -160.08 149.29 14.1 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.495 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.707 ' HA ' HG12 ' A' ' 30' ' ' VAL . 74.3 Cg_endo -75.17 46.92 1.66 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.622 2.215 . . . . 0.0 112.907 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.211 0 CA-C-O 120.972 0.415 . . . . 0.0 111.244 179.853 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.868 0.366 . . . . 0.0 111.023 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -101.33 88.88 3.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.054 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.635 ' CD2' HG23 ' A' ' 40' ' ' THR . 11.1 m170 -76.69 109.01 10.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.932 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.741 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 21.5 t -109.89 150.84 12.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.102 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 87.1 p -87.48 157.24 19.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.906 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.4 ' HA ' HD12 ' A' ' 125' ' ' LEU . 1.5 tp -120.67 31.75 6.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.923 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -133.39 38.38 3.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.707 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.765 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 1.4 mtt 177.6 -34.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.874 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.459 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -55.0 -171.53 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.988 0.423 . . . . 0.0 111.31 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -168.44 116.56 0.7 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.434 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.557 HG11 ' N ' ' A' ' 173' ' ' GLN . 1.9 p -88.04 158.47 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.314 0.578 . . . . 0.0 111.579 -179.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.467 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 93.6 p -168.48 159.2 10.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.756 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 16.8 ptt85 -132.89 126.59 32.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.042 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.804 179.775 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.418 ' CD2' ' HD3' ' A' ' 158' ' ' ARG . 58.3 m-85 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.851 0.358 . . . . 0.0 110.942 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 1.045 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.3 OUTLIER -84.96 112.67 20.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.71 179.888 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . 0.423 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.8 tt0 -108.12 131.23 54.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.986 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.405 HG12 HG23 ' A' ' 130' ' ' VAL . 35.6 mt -132.32 110.98 17.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.189 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.459 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 30.7 p -91.66 155.36 18.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.908 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.804 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -132.89 145.83 51.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.105 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.765 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -94.54 30.51 1.98 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.289 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -119.41 47.04 1.77 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.171 0.51 . . . . 0.0 110.115 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.23 17.06 4.57 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.266 -179.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.4 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 2.8 mm-40 61.11 63.95 1.18 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.049 0.452 . . . . 0.0 110.91 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.804 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 28.1 m-20 -91.07 162.69 14.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.818 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.28 96.04 0.48 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.157 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 9.4 m -90.63 124.97 43.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.199 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.423 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 0.5 OUTLIER -105.96 87.13 2.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.807 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.46 HD13 HD21 ' A' ' 32' ' ' LEU . 2.2 mt -99.86 171.25 7.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.98 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.418 ' HD3' ' CD2' ' A' ' 143' ' ' TYR . 6.5 ttp85 -143.58 116.33 8.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.884 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -70.84 172.87 8.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.205 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.74 -31.38 13.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.009 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -110.89 157.52 19.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.868 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -73.83 -57.12 4.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.851 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -61.08 -32.45 72.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.075 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 2.9 m -64.62 -52.58 56.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.8 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.884 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -59.67 -36.89 77.35 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.051 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -45.23 60.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.365 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 59.8 p -66.52 -32.4 73.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.1 179.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.592 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.1 m95 -72.56 -49.88 29.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.743 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 1.045 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -58.92 -47.33 85.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.314 0.578 . . . . 0.0 110.385 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -59.7 -40.89 97.13 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.525 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.91 -40.29 72.24 Favored 'General case' 0 CA--C 1.51 -0.592 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.894 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.863 HG22 HD12 ' A' ' 176' ' ' ILE . 10.9 mt -60.98 -24.51 33.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 177.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.557 ' N ' HG11 ' A' ' 130' ' ' VAL . 19.5 tt0 -85.3 -25.91 26.91 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.507 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.83 -42.49 73.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.196 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -76.01 -39.99 54.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.814 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.863 HD12 HG22 ' A' ' 172' ' ' ILE . 67.4 mt -80.7 -9.46 12.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.362 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.287 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.449 179.859 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo . . . . . 0 C--O 1.232 0.225 0 CA-C-O 120.916 0.298 . . . . 0.0 112.45 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -86.26 136.63 33.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.697 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.738 HG22 ' HA ' ' A' ' 33' ' ' SER . 34.0 p -136.45 148.39 47.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.954 0.407 . . . . 0.0 111.35 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.26 162.36 30.15 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.194 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.802 HD13 ' NH1' ' A' ' 29' ' ' ARG . 7.3 mt -82.98 132.93 35.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.791 0.329 . . . . 0.0 110.989 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.627 HD22 ' CB ' ' A' ' 157' ' ' LEU . 0.2 OUTLIER -146.87 145.52 29.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.738 179.815 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -79.84 158.33 26.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.104 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 12.6 tp -141.89 128.97 20.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.411 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.469 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 29.5 ttp180 . . . . . 0 C--N 1.331 -0.228 0 CA-C-O 120.894 0.378 . . . . 0.0 110.904 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.469 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 39.6 m95 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.767 0.318 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -160.74 152.66 19.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.959 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.802 ' NH1' HD13 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -77.54 120.14 22.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.921 179.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.401 HG21 ' HB2' ' A' ' 14' ' ' LEU . 33.3 m -130.1 133.86 63.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.062 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 12.0 tp -74.7 143.34 44.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.758 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.555 HD13 ' HB2' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -111.33 137.03 49.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.957 -179.845 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.738 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.8 OUTLIER -118.56 94.4 4.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.799 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.486 HD22 HD13 ' A' ' 172' ' ' ILE . 7.6 tp -89.31 115.3 26.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.962 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.406 ' N ' HD12 ' A' ' 34' ' ' LEU . . . -117.89 149.11 41.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.702 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.82 -15.54 31.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.31 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.401 ' O ' ' HB2' ' A' ' 38' ' ' ALA . 3.2 p30 -95.29 -26.85 15.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.236 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.681 ' HA ' HD13 ' A' ' 125' ' ' LEU . . . 179.05 171.65 0.86 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.806 0.336 . . . . 0.0 111.302 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.582 ' HB3' HG23 ' A' ' 123' ' ' VAL . 3.2 tm? -106.25 115.42 30.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.709 179.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.8 m -116.72 123.38 47.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.15 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.541 HG13 HD12 ' A' ' 32' ' ' LEU . 16.9 t -103.81 159.58 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.894 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.49 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.4 OUTLIER -167.34 166.47 8.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.783 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -64.52 148.26 90.54 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.577 2.185 . . . . 0.0 112.259 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.578 ' HB1' HD21 ' A' ' 11' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.054 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.481 ' HB3' ' NE2' ' A' ' 122' ' ' HIS . . . . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 120.822 0.344 . . . . 0.0 111.106 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -105.52 92.55 4.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.834 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.481 ' NE2' ' HB3' ' A' ' 120' ' ' ALA . 7.3 m-70 -93.77 109.49 21.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.198 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.593 HG12 ' CB ' ' A' ' 148' ' ' ALA . 0.6 OUTLIER -116.55 121.83 68.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.762 179.64 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 10.6 t -56.57 140.09 47.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.826 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.681 HD13 ' HA ' ' A' ' 38' ' ' ALA . 1.9 mp -97.39 31.11 2.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.981 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 mtmm -133.65 32.18 3.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.531 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.584 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -177.55 -36.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.83 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.561 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -54.94 -172.34 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.172 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -168.77 120.65 0.78 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.843 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.578 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.0 p -94.38 159.12 2.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.196 0.522 . . . . 0.0 111.123 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.468 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 13.6 t -164.46 155.11 14.85 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.846 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 21.2 ttp180 -121.52 84.04 2.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.642 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.899 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 1.5 t80 . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.926 0.393 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 1.042 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.9 OUTLIER -96.79 119.61 35.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.695 179.662 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . 0.428 ' HG3' ' CE1' ' A' ' 156' ' ' PHE . 9.0 tt0 -125.81 138.22 53.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.066 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.507 HD13 HG21 ' A' ' 172' ' ' ILE . 14.2 mt -134.95 112.8 15.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.073 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.561 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 18.5 m -88.48 162.07 16.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.03 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.687 ' HB3' ' HB3' ' A' ' 153' ' ' ASP . . . -144.09 146.51 32.86 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.171 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.584 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.03 30.24 2.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.337 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.22 45.47 1.76 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.131 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 117.05 23.01 4.03 Favored Glycine 0 N--CA 1.449 -0.459 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.14 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.409 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 3.8 mm-40 58.78 61.93 2.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 121.096 0.474 . . . . 0.0 110.84 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.687 ' HB3' ' HB3' ' A' ' 148' ' ' ALA . 20.2 t0 -88.66 161.95 16.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.883 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -168.38 89.82 0.26 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.144 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.481 HG22 ' HB ' ' A' ' 146' ' ' ILE . 30.2 m -77.5 132.89 31.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.127 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.428 ' CE1' ' HG3' ' A' ' 145' ' ' GLU . 68.0 m-85 -111.03 92.04 3.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.647 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.627 ' CB ' HD22 ' A' ' 12' ' ' LEU . 1.8 mt -104.04 160.19 15.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.19 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.468 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 2.9 ttt180 -133.38 97.17 3.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.828 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.948 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -54.34 171.28 0.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.247 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.85 -31.05 11.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.841 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -108.36 171.53 7.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.861 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.27 -55.65 3.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.967 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.41 -28.17 68.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.206 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -52.27 37.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.7 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.948 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -61.47 -37.43 83.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.949 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -73.19 -44.04 60.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.311 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 24.8 t -66.42 -33.24 75.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.874 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.444 ' O ' HG12 ' A' ' 172' ' ' ILE . 11.5 m95 -72.5 -52.49 15.49 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.75 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 1.042 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -56.24 -45.87 79.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.291 0.567 . . . . 0.0 110.467 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.9 -44.54 96.01 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.527 -0.761 . . . . 0.0 112.734 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.09 -40.81 82.57 Favored 'General case' 0 CA--C 1.51 -0.571 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.176 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.785 HG22 HD12 ' A' ' 176' ' ' ILE . 20.8 mm -60.4 -24.91 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.578 ' N ' HG11 ' A' ' 130' ' ' VAL . 30.8 tt0 -83.63 -26.15 30.18 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.571 179.416 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.66 -49.31 63.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.21 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . 0.657 ' HB3' HD23 ' A' ' 125' ' ' LEU . 1.9 mp0 -69.65 -41.26 75.82 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.787 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.785 HD12 HG22 ' A' ' 172' ' ' ILE . 67.5 mt -80.05 -3.03 5.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.378 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 0.419 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.643 179.905 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo . . . . . 0 N--CA 1.466 -0.125 0 CA-C-O 120.857 0.274 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.44 146.19 36.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.786 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.881 HG22 ' HA ' ' A' ' 33' ' ' SER . 58.8 p -140.44 152.95 46.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.095 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -158.63 123.9 1.31 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.328 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 18.4 mt -64.28 100.73 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.875 0.369 . . . . 0.0 110.926 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.759 HD13 HD22 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -106.61 170.03 8.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.895 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.536 ' O ' HD23 ' A' ' 157' ' ' LEU . 0.2 OUTLIER -107.88 155.97 19.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.979 -179.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 13.2 tp -134.37 127.8 32.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.638 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.43 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.7 OUTLIER . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.852 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.477 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 46.6 m95 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.801 0.334 . . . . 0.0 110.962 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -147.39 152.61 38.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.018 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -80.63 121.32 25.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.041 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.666 HG12 ' HA ' ' A' ' 43' ' ' PRO . 31.9 m -134.52 137.82 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.135 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tp -86.16 127.8 34.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.616 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.759 HD22 HD13 ' A' ' 12' ' ' LEU . 0.9 OUTLIER -100.16 103.44 14.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.015 -179.768 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.881 ' HA ' HG22 ' A' ' 9' ' ' THR . 2.7 m -82.24 78.57 8.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.657 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.848 HD12 ' HG ' ' A' ' 39' ' ' LEU . 3.6 tp -74.48 93.29 2.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.17 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.46 147.8 22.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.916 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.2 -14.76 52.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.512 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.41 -17.33 14.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.237 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.423 ' C ' HD22 ' A' ' 125' ' ' LEU . . . -174.23 173.71 3.02 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.78 0.324 . . . . 0.0 111.128 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.848 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -121.37 104.63 9.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.895 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.504 HG23 ' CD2' ' A' ' 122' ' ' HIS . 21.3 m -101.45 155.03 18.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.041 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.643 HG13 HD12 ' A' ' 32' ' ' LEU . 16.2 t -138.78 159.11 30.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.147 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.485 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -165.19 158.33 13.92 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.542 179.92 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.666 ' HA ' HG12 ' A' ' 30' ' ' VAL . 6.6 Cg_exo -73.85 42.02 0.68 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.768 2.312 . . . . 0.0 112.78 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.159 0 CA-C-O 121.032 0.444 . . . . 0.0 111.302 179.923 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.426 ' HB3' ' CE1' ' A' ' 122' ' ' HIS . . . . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.82 0.343 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.519 ' HE2' HG13 ' A' ' 155' ' ' VAL . 5.5 tttp -84.47 95.28 8.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.767 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.504 ' CD2' HG23 ' A' ' 40' ' ' THR . 73.3 m80 -91.16 103.11 15.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.089 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 39' ' ' LEU . 6.6 t -81.81 118.06 28.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.725 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -49.25 -34.55 15.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.516 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.614 HD13 ' HB2' ' A' ' 39' ' ' LEU . 3.8 tp 60.22 -165.21 0.21 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.665 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 54.88 38.78 30.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.991 0.424 . . . . 0.0 110.773 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.7 mtt 173.42 -30.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.762 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.06 -167.75 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.296 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.448 ' CD1' ' N ' ' A' ' 129' ' ' TYR . 0.0 OUTLIER -159.77 120.13 3.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.62 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.657 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.4 p -94.52 159.53 2.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.31 0.576 . . . . 0.0 111.272 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.481 ' N ' HG22 ' A' ' 130' ' ' VAL . 1.0 OUTLIER -169.1 125.46 0.92 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.862 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 -95.89 86.65 4.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.967 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.881 179.867 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.775 0.321 . . . . 0.0 110.849 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.465 HD11 ' HA ' ' A' ' 165' ' ' ALA . 0.2 OUTLIER -99.17 109.2 21.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.734 179.95 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -114.36 142.32 46.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.735 HD13 HG21 ' A' ' 172' ' ' ILE . 24.0 mt -146.31 107.18 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.91 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 11.7 m -92.77 133.38 36.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.052 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.68 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -108.5 150.21 27.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.406 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.24 30.69 2.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.294 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -116.3 45.78 1.71 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.075 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.22 23.49 3.2 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.145 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.412 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.5 mm-40 57.16 59.59 3.34 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.07 0.462 . . . . 0.0 111.084 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.68 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.8 m-20 -85.74 158.61 19.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.545 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -157.98 91.66 1.13 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.206 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.519 HG13 ' HE2' ' A' ' 121' ' ' LYS . 6.6 m -92.02 117.87 36.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.219 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -110.26 83.18 1.71 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.778 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.536 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.3 mt -90.35 166.58 13.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.034 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.463 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 24.0 ttp180 -131.28 105.9 7.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.793 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.799 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -56.67 170.13 0.42 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.271 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.76 -30.49 20.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.988 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -119.11 168.87 10.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.931 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -78.02 -57.37 3.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.872 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -58.77 -35.38 72.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.173 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 168' ' ' TRP . 16.8 p -61.33 -51.89 66.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.919 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.799 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -58.67 -39.03 79.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.191 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.21 -45.42 66.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.716 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 4.9 m -67.42 -32.58 73.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.007 0.432 . . . . 0.0 110.254 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.728 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 5.1 m95 -72.98 -47.86 41.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.828 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.535 ' HA ' HD12 ' A' ' 172' ' ' ILE . . . -56.79 -58.57 7.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.315 0.579 . . . . 0.0 110.164 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.31 -40.13 60.11 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.558 -0.747 . . . . 0.0 112.588 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.35 -41.02 81.31 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.791 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.735 HG21 HD13 ' A' ' 146' ' ' ILE . 10.8 mt -59.64 -24.0 27.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 177.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.657 ' N ' HG11 ' A' ' 130' ' ' VAL . 11.5 tt0 -77.39 -37.57 51.73 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.013 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -59.35 -47.68 84.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.538 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -37.29 77.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.063 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.479 HD12 HG22 ' A' ' 172' ' ' ILE . 49.3 mt -68.29 -29.15 43.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.039 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 0.254 0 C-N-CA 120.398 -0.906 . . . . 0.0 112.936 179.851 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo . . . . . 0 C--O 1.23 0.118 0 CA-C-O 120.854 0.273 . . . . 0.0 112.375 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -93.83 142.24 27.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.823 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.92 HG22 ' HA ' ' A' ' 33' ' ' SER . 38.1 p -140.77 161.61 37.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.943 0.402 . . . . 0.0 111.213 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.56 140.41 5.55 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.356 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 26.8 mt -61.14 120.72 10.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.927 0.394 . . . . 0.0 110.959 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.806 HD13 HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -132.78 154.94 49.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.743 179.915 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.54 160.25 20.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.905 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 46.1 tp -141.31 126.44 18.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.632 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.437 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 2.4 ttm180 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.618 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.438 ' CH2' ' HB2' ' A' ' 158' ' ' ARG . 31.3 m95 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.659 0.266 . . . . 0.0 110.755 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.51 168.71 26.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.839 0.352 . . . . 0.0 111.068 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 -92.24 137.01 32.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.975 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 30' ' ' VAL . 29.3 m -156.44 120.77 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.021 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.2 tp -69.73 128.24 35.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.703 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.806 HD22 HD13 ' A' ' 12' ' ' LEU . 7.5 mp -92.98 139.73 30.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.99 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.92 ' HA ' HG22 ' A' ' 9' ' ' THR . 3.3 t -113.48 77.43 1.05 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.681 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.5 ' HA ' HD22 ' A' ' 39' ' ' LEU . 7.5 tp -72.99 96.25 2.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.86 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -96.29 148.09 23.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.905 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.26 -13.45 38.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.511 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -103.45 -19.03 14.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.391 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.703 ' HA ' HD13 ' A' ' 125' ' ' LEU . . . -176.2 174.42 2.02 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.968 0.413 . . . . 0.0 111.38 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.539 ' C ' HD13 ' A' ' 39' ' ' LEU . 3.0 tm? -112.94 93.94 4.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.67 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.407 HG23 ' CD2' ' A' ' 122' ' ' HIS . 20.8 m -98.99 134.74 41.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.94 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.636 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 13.1 t -106.27 158.59 6.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.98 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.449 ' N ' HG12 ' A' ' 41' ' ' VAL . 14.9 p -146.56 152.12 44.7 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.787 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.72 44.48 1.43 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.611 2.207 . . . . 0.0 112.688 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.194 0 CA-C-O 121.097 0.475 . . . . 0.0 111.188 -179.941 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.636 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.809 0.338 . . . . 0.0 111.198 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.401 ' HE2' ' CG1' ' A' ' 155' ' ' VAL . 44.8 tttp -105.38 84.74 2.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.89 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.407 ' CD2' HG23 ' A' ' 40' ' ' THR . 10.5 m-70 -73.84 92.21 2.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.866 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.481 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 27.4 t -85.97 120.44 35.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.171 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 1.7 m -68.53 131.85 45.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.88 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.703 HD13 ' HA ' ' A' ' 38' ' ' ALA . 1.2 mp -87.88 -168.19 2.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.857 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.07 32.69 17.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.761 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.641 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 3.2 mtt -171.04 -41.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.001 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.23 -169.69 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.138 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.467 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.3 OUTLIER -170.2 122.88 0.68 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.472 179.797 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.601 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.3 p -96.45 158.8 3.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.342 0.591 . . . . 0.0 111.539 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' HG22 ' A' ' 130' ' ' VAL . 15.8 m -151.93 166.4 31.61 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.645 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.2 ttp180 -134.04 85.8 2.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.062 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.872 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.85 0.357 . . . . 0.0 110.879 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.653 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.4 OUTLIER -111.6 115.14 28.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.581 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -117.66 136.46 53.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.055 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.619 HD13 HG21 ' A' ' 172' ' ' ILE . 28.7 mt -135.94 104.24 4.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.978 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 29.7 m -90.1 136.42 33.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.957 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -114.65 150.8 34.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.041 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.641 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -94.06 30.92 1.76 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.5 -179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -110.67 42.81 1.52 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.035 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.68 25.71 2.54 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.118 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.417 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 5.8 mm-40 56.75 59.42 3.54 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.035 0.445 . . . . 0.0 110.934 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -94.08 162.75 13.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.805 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.39 93.42 0.85 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.182 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.401 ' CG1' ' HE2' ' A' ' 121' ' ' LYS . 6.6 m -83.23 128.31 38.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.13 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.437 ' CE1' ' HB3' ' A' ' 15' ' ' ARG . 0.2 OUTLIER -109.12 93.11 4.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.751 -179.91 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.583 HD22 HD11 ' A' ' 32' ' ' LEU . 1.3 mp -96.71 167.52 11.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.077 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.438 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -130.75 112.81 13.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.811 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.883 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -67.56 172.13 5.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.14 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -85.59 -66.05 0.94 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.024 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -97.96 170.86 8.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.881 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.01 -47.44 58.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.032 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.25 -38.4 90.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.139 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 30.4 t -61.75 -47.66 84.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.868 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.883 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -60.47 -41.2 93.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.224 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 51.9 mtp180 -70.08 -44.06 69.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.543 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.3 -34.32 77.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.054 179.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.403 ' O ' HD12 ' A' ' 172' ' ' ILE . 11.2 m95 -74.26 -50.86 17.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.834 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.653 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -56.23 -51.58 67.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.399 0.619 . . . . 0.0 110.491 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.94 -40.81 95.82 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.798 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.21 -41.09 77.55 Favored 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.355 -179.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.717 HG22 HD12 ' A' ' 176' ' ' ILE . 6.8 mt -62.65 -23.18 31.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.601 ' N ' HG11 ' A' ' 130' ' ' VAL . 54.2 tt0 -80.66 -30.52 36.55 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.315 179.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.57 -47.34 76.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.338 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . 0.568 ' HB3' HD21 ' A' ' 125' ' ' LEU . 2.0 mp0 -70.55 -39.37 74.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.998 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.717 HD12 HG22 ' A' ' 172' ' ' ILE . 84.5 mt -78.11 -9.95 12.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.195 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.448 179.88 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo . . . . . 0 N--CA 1.465 -0.153 0 CA-C-O 120.794 0.247 . . . . 0.0 112.306 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.63 155.76 25.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.813 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.758 HG22 ' HA ' ' A' ' 33' ' ' SER . 74.6 p -144.35 138.12 27.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.968 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -136.72 121.62 2.41 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.435 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.548 HD22 ' HD3' ' A' ' 29' ' ' ARG . 31.0 mt -68.53 114.09 6.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.876 0.37 . . . . 0.0 110.921 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.455 HD22 ' HB2' ' A' ' 157' ' ' LEU . 0.2 OUTLIER -129.21 150.24 50.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.72 179.877 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -83.58 163.22 20.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.036 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 39.6 tp -130.95 126.63 36.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.636 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.473 ' HA ' ' CD2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.63 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.473 ' CD2' ' HA ' ' A' ' 15' ' ' ARG . 22.1 m95 . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.709 0.29 . . . . 0.0 110.655 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -146.47 -175.02 4.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.994 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.548 ' HD3' HD22 ' A' ' 11' ' ' LEU . 0.3 OUTLIER -109.98 137.34 47.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 26.2 m -151.19 128.02 2.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.12 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.2 tp -81.98 127.23 32.85 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.424 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.468 HD12 HG13 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -94.16 92.78 7.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.104 -179.623 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.758 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.7 OUTLIER -73.15 89.22 1.49 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.579 179.462 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.711 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 4.6 tp -84.65 119.86 25.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.152 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -122.83 138.8 54.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.022 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -56.77 -23.2 41.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.462 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -89.55 -29.95 18.56 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.006 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.862 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -175.72 166.82 3.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.135 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.558 HD11 HG23 ' A' ' 172' ' ' ILE . 0.2 OUTLIER -103.56 152.93 21.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.752 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 88.3 m -158.21 132.64 8.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.772 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.635 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 14.7 t -117.86 159.26 18.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.214 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.483 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -155.31 176.27 2.64 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.539 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.412 ' HD2' ' CB ' ' A' ' 42' ' ' SER . 84.7 Cg_endo -82.25 38.52 0.75 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.531 2.154 . . . . 0.0 112.841 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.261 0 CA-C-O 121.116 0.484 . . . . 0.0 111.07 179.964 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.635 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.787 0.327 . . . . 0.0 111.103 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -101.4 97.72 8.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.88 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -88.94 113.94 25.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.961 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.788 HG13 ' HB2' ' A' ' 148' ' ' ALA . 21.7 t -103.18 137.92 29.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.085 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.646 ' C ' HD22 ' A' ' 125' ' ' LEU . 0.3 OUTLIER -76.27 159.79 30.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.868 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.862 HD23 ' HA ' ' A' ' 38' ' ' ALA . 4.2 mm? -123.6 34.36 5.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.974 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.29 34.84 1.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.964 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 3.3 ptp 178.55 -37.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.0 -177.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.324 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.415 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.2 OUTLIER -159.23 124.36 4.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.461 179.918 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.699 HG12 HD12 ' A' ' 176' ' ' ILE . 2.9 p -101.27 159.95 3.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.318 0.58 . . . . 0.0 111.497 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.519 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -161.45 156.13 23.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.994 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.65 139.72 53.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.772 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.793 -179.98 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.836 0.351 . . . . 0.0 111.057 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.855 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 1.2 mt -94.23 116.14 28.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.753 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -108.98 130.29 55.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.87 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.445 HG12 HG23 ' A' ' 130' ' ' VAL . 35.6 mt -132.91 120.72 42.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.097 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 35.8 t -109.78 124.27 50.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.777 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.788 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -108.53 147.51 31.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.21 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.47 30.74 2.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.179 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -112.09 42.75 1.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.404 179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.68 25.28 2.17 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.955 -0.641 . . . . 0.0 112.359 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.56 60.55 2.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.068 0.461 . . . . 0.0 110.923 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.523 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 1.5 m-20 -93.31 148.38 22.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.861 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -155.64 90.41 1.24 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.092 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 27.2 m -88.94 131.2 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.21 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -118.0 96.29 5.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.68 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.455 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.7 OUTLIER -103.28 167.06 10.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.041 -179.712 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.455 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 69.2 ttt180 -132.8 101.16 5.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.719 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.517 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -58.85 173.49 0.43 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.158 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.06 -33.27 10.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.935 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.03 -170.01 1.78 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.822 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -108.21 -56.66 2.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.71 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.39 -29.91 70.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.872 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 3.4 m -65.25 -47.48 76.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.504 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.572 ' HA ' HD11 ' A' ' 144' ' ' LEU . . . -61.54 -46.05 91.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.026 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -69.64 -37.91 76.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.518 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 88.5 p -70.01 -34.21 73.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.167 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.711 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 6.9 m95 -73.06 -48.88 32.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.865 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.855 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -57.3 -51.82 67.82 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.359 0.599 . . . . 0.0 110.486 179.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.82 -40.87 93.62 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.748 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.96 76.39 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.049 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.564 HG22 ' CD1' ' A' ' 176' ' ' ILE . 9.5 mt -61.62 -22.83 29.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.539 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -71.11 -55.53 8.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.477 179.239 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -52.73 -37.74 59.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.119 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.43 -30.46 57.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.311 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.699 HD12 HG12 ' A' ' 130' ' ' VAL . 19.4 mt -71.33 -25.91 25.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.913 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.336 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.788 179.593 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo . . . . . 0 C--O 1.231 0.14 0 CA-C-O 120.794 0.247 . . . . 0.0 112.452 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.536 ' NH2' ' HB1' ' A' ' 171' ' ' ALA . 34.3 ttp180 -97.56 143.42 28.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.977 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.0 p -141.44 154.6 45.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.938 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -159.6 135.79 4.3 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.535 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.506 HD22 ' HB1' ' A' ' 44' ' ' ALA . 66.4 mt -66.56 105.3 1.47 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.806 0.336 . . . . 0.0 110.989 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.575 HD13 HD22 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -116.26 152.34 34.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.819 179.92 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.425 ' HB3' ' CE3' ' A' ' 27' ' ' TRP . 4.5 tt0 -78.93 170.11 17.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.878 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.407 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 39.7 tp -145.33 120.81 10.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.74 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.467 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.453 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.467 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 21.7 m95 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.792 0.33 . . . . 0.0 110.776 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.56 175.88 5.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.88 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -105.62 127.03 52.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.958 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.4 m -141.46 130.26 23.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.109 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.7 tp -73.5 124.9 26.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.751 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.82 HD12 HG13 ' A' ' 41' ' ' VAL . 1.9 tp -92.39 125.38 37.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.972 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.14 87.89 3.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.78 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.728 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 4.8 tp -84.09 123.14 29.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.015 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -134.28 139.77 45.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.016 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.36 -23.53 49.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.103 0.478 . . . . 0.0 111.278 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -83.77 -31.17 26.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.89 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.685 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -174.62 169.1 3.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.262 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.521 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -112.76 106.58 14.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.723 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 28.0 m -115.7 132.04 56.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.997 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.82 HG13 HD12 ' A' ' 32' ' ' LEU . 17.6 t -106.24 160.15 5.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.921 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.479 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -165.44 167.17 9.62 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.764 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.63 148.45 65.93 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.571 2.181 . . . . 0.0 112.267 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.506 ' HB1' HD22 ' A' ' 11' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.004 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.768 0.318 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.06 78.03 1.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.861 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 -71.46 146.75 48.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.057 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.4 t -149.45 113.29 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.067 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.18 147.73 52.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.064 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' A' ' 176' ' ' ILE . 3.0 mm? -98.31 -176.95 3.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.741 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 67.62 45.41 1.5 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.989 0.423 . . . . 0.0 110.95 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.578 ' HG2' ' HB3' ' A' ' 149' ' ' ALA . 0.2 OUTLIER 178.45 -37.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.768 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.696 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -68.09 -176.57 0.72 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.173 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.473 ' HA ' HG21 ' A' ' 176' ' ' ILE . 53.3 p90 -162.23 115.15 1.74 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.807 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.563 HG11 ' N ' ' A' ' 173' ' ' GLN . 1.6 p -78.78 158.92 4.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.274 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.473 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.9 OUTLIER -164.59 119.04 1.38 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.672 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 17.0 ptt-85 -94.05 86.35 4.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.866 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 10.0 mtt85 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.869 179.839 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.746 0.308 . . . . 0.0 110.758 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.658 HD12 ' HB2' ' A' ' 159' ' ' ALA . 2.3 mt -84.94 86.15 7.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.638 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.41 131.41 53.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.902 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.868 HD13 HG21 ' A' ' 172' ' ' ILE . 28.8 mt -126.87 137.38 58.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.082 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.696 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 0.8 OUTLIER -107.17 158.9 16.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.83 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.917 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -136.86 144.07 43.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.204 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.578 ' HB3' ' HG2' ' A' ' 127' ' ' MET . . . -95.73 31.16 2.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.234 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -116.44 44.88 1.9 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.457 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.74 23.22 3.12 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.432 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 59.62 62.0 1.84 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.034 0.445 . . . . 0.0 110.798 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.917 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 5.0 m-20 -94.76 156.42 16.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.814 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.82 93.64 0.82 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.152 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.2 m -83.19 130.13 36.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.162 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -106.56 89.56 3.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.837 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.3 mt -105.39 155.98 18.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.046 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.439 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 13.6 ttm180 -127.01 112.37 15.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.792 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.852 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -57.88 173.51 0.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.124 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.91 -31.11 11.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.99 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.92 -179.59 3.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -87.63 -59.16 2.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.875 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -62.24 -33.25 74.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.128 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.89 -44.86 84.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.753 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.852 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -64.37 -43.56 94.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.022 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.78 -41.07 75.61 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.158 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 60.5 p -65.32 -40.67 94.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.728 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 8.7 m95 -66.52 -55.59 14.83 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.505 179.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.47 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -46.02 -64.99 0.61 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.19 0.519 . . . . 0.0 110.897 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -49.7 -36.77 26.13 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.105 179.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . 0.536 ' HB1' ' NH2' ' A' ' 8' ' ' ARG . . . -69.0 -40.35 78.77 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.968 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.868 HG21 HD13 ' A' ' 146' ' ' ILE . 30.6 mm -59.68 -24.28 28.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 177.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.563 ' N ' HG11 ' A' ' 130' ' ' VAL . 2.7 tt0 -75.71 -44.64 40.98 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.779 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.76 -48.69 77.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.169 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -71.21 -32.06 68.36 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.067 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.721 ' HA ' HD12 ' A' ' 125' ' ' LEU . 7.0 mt -66.04 -28.85 44.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.619 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.361 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.632 179.786 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo . . . . . 0 C--O 1.231 0.155 0 CA-C-O 120.879 0.283 . . . . 0.0 112.395 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.96 121.31 42.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.423 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.42 HG22 ' HA ' ' A' ' 33' ' ' SER . 9.0 p -132.25 139.56 48.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.014 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.82 143.35 12.15 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.485 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' A' ' 11' ' ' LEU . 6.7 mt -69.52 106.98 3.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.764 0.316 . . . . 0.0 110.891 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.044 HD21 HD12 ' A' ' 144' ' ' LEU . 0.2 OUTLIER -121.95 144.22 49.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.649 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.431 ' O ' HD23 ' A' ' 157' ' ' LEU . 18.4 mt-10 -84.02 155.82 22.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.948 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tp -136.09 137.78 41.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.664 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.492 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.679 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.492 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 26.9 m95 . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.886 0.375 . . . . 0.0 111.139 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -108.6 146.86 32.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.806 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.7 ttt85 -72.9 136.07 45.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.008 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 42' ' ' SER . 35.1 m -141.17 169.95 14.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.109 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 tp -120.63 117.25 27.05 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.641 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.632 ' HG ' HG22 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -87.93 110.49 20.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.947 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.42 ' HA ' HG22 ' A' ' 9' ' ' THR . 7.8 t -89.85 79.86 6.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.666 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.99 HD12 HD23 ' A' ' 39' ' ' LEU . 1.1 tp -77.11 99.83 5.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.046 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.68 147.54 27.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.935 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -61.9 -16.22 48.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.444 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.49 -27.28 18.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.861 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.869 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -176.78 -179.74 1.0 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.974 0.416 . . . . 0.0 111.255 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.99 HD23 HD12 ' A' ' 34' ' ' LEU . 3.1 tm? -117.29 114.29 23.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.859 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 58.4 m -127.72 134.77 49.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.986 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.632 HG22 ' HG ' ' A' ' 32' ' ' LEU . 14.6 t -111.7 159.01 11.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.3 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.482 ' N ' HG12 ' A' ' 41' ' ' VAL . 9.9 p -148.04 160.64 37.05 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.372 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.405 ' HA ' HG12 ' A' ' 30' ' ' VAL . 72.2 Cg_endo -77.11 47.43 2.23 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.496 2.131 . . . . 0.0 112.871 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.149 0 CA-C-O 121.018 0.437 . . . . 0.0 111.549 179.843 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.088 0 CA-C-O 120.717 0.294 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 17.1 mttm -101.8 90.66 4.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.928 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 19.7 m80 -84.98 138.91 32.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 19.2 t -138.45 116.88 13.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.074 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 92.5 p -70.8 125.15 26.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.905 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.869 HD23 ' HA ' ' A' ' 38' ' ' ALA . 4.1 mm? -66.52 -179.48 0.84 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.917 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 60.48 35.77 20.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.859 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.41 ' SD ' ' HB3' ' A' ' 149' ' ' ALA . 2.5 mmt -164.74 -44.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.89 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.64 -165.54 0.06 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.256 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.648 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.1 OUTLIER -169.86 127.07 0.87 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.503 179.92 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.585 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.5 p -99.84 158.88 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.361 0.6 . . . . 0.0 111.646 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.481 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -166.5 133.0 2.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.677 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.444 ' HD3' ' HB3' ' A' ' 169' ' ' ALA . 39.4 ptt85 -102.96 96.05 6.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.846 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.914 -179.952 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.452 ' CZ ' ' CD ' ' A' ' 158' ' ' ARG . 15.0 m-85 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.817 0.342 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 1.044 HD12 HD21 ' A' ' 12' ' ' LEU . 80.8 mt -83.58 132.63 34.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.777 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -133.68 125.36 28.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.789 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.493 HD11 HD13 ' A' ' 172' ' ' ILE . 22.8 mt -130.46 117.99 41.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.187 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 35.5 m -100.3 143.55 30.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.829 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.817 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -112.77 149.01 33.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.308 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.41 ' HB3' ' SD ' ' A' ' 127' ' ' MET . . . -95.92 30.58 2.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.255 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -120.98 48.15 1.69 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.074 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.35 19.11 3.58 Favored Glycine 0 N--CA 1.451 -0.332 0 CA-C-N 115.615 -0.72 . . . . 0.0 112.173 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.408 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 4.8 mm-40 58.45 61.14 2.34 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 121.123 0.487 . . . . 0.0 111.063 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.817 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.9 m-20 -87.6 161.97 17.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.835 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.61 93.7 0.84 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.1 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.0 m -85.71 124.57 40.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.029 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -105.98 106.06 16.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.765 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.431 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.8 mt -113.76 164.6 13.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.076 -179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.452 ' CD ' ' CZ ' ' A' ' 143' ' ' TYR . 1.3 tpt180 -130.96 97.29 4.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.694 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.817 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.52 174.15 0.11 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.413 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -88.85 -67.21 0.85 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.003 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.39 173.84 7.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.105 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.52 -34.01 25.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.923 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -74.2 -46.33 42.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.936 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.5 -39.97 95.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.651 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.817 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -66.69 -42.34 86.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.997 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.7 mtt180 -70.7 -40.68 72.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.55 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 41.9 p -67.98 -33.05 73.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.145 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.596 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.7 m95 -73.0 -50.86 20.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.875 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.737 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -56.45 -50.06 72.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.306 0.574 . . . . 0.0 110.467 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.26 -42.2 95.32 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.647 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.04 -40.53 78.54 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.964 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.756 HG22 HD12 ' A' ' 176' ' ' ILE . 31.8 mt -60.89 -24.51 32.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.585 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.1 OUTLIER -81.77 -28.78 33.09 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.219 179.161 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.76 -50.54 66.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.128 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -67.29 -41.54 85.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.856 178.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.756 HD12 HG22 ' A' ' 172' ' ' ILE . 83.1 mt -77.39 -5.59 7.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.224 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.331 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.541 179.847 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo . . . . . 0 C--O 1.231 0.158 0 CA-C-O 120.775 0.24 . . . . 0.0 112.36 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.764 ' HB3' HD23 ' A' ' 34' ' ' LEU . 5.4 ttm105 -70.59 133.98 47.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.874 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.462 HG22 ' HA ' ' A' ' 33' ' ' SER . 75.2 p -135.17 138.86 44.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.005 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.51 126.88 2.9 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.38 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.623 HD13 HH11 ' A' ' 29' ' ' ARG . 64.4 mt -68.85 99.38 1.03 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.823 0.344 . . . . 0.0 110.937 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.607 HD22 ' CB ' ' A' ' 157' ' ' LEU . 0.2 OUTLIER -106.03 151.17 24.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.788 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -88.35 134.79 33.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.513 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 20.6 tp -108.39 139.17 43.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.495 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.539 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.226 0 CA-C-O 120.746 0.307 . . . . 0.0 110.918 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.539 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 33.5 m95 . . . . . 0 CA--C 1.528 0.106 0 CA-C-O 120.796 0.331 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -89.65 -176.69 5.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.686 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.623 HH11 HD13 ' A' ' 11' ' ' LEU . 0.7 OUTLIER -106.41 130.08 54.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.851 0.358 . . . . 0.0 110.911 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 33.8 m -137.11 134.14 47.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.264 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 10.5 tp -78.86 128.12 32.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.7 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.658 HD12 HG13 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -99.38 123.6 43.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.045 -179.907 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.462 ' HA ' HG22 ' A' ' 9' ' ' THR . 1.1 t -97.51 89.87 4.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.708 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.774 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 2.5 tp -93.56 95.11 9.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.04 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.46 153.11 22.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.915 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -64.44 -14.04 54.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.409 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -96.13 -21.94 17.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.094 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.777 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -178.15 174.2 1.38 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.844 0.354 . . . . 0.0 111.134 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.601 HD13 HD12 ' A' ' 34' ' ' LEU . 21.6 tp -131.21 97.5 4.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.773 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 51.8 m -111.53 137.44 49.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.946 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.658 HG13 HD12 ' A' ' 32' ' ' LEU . 15.6 t -100.25 159.55 3.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.047 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.482 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -170.05 149.71 3.43 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.814 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.89 153.06 16.0 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.511 2.141 . . . . 0.0 112.13 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.122 -179.985 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.649 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.853 0.358 . . . . 0.0 111.06 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.455 ' HD2' HG12 ' A' ' 155' ' ' VAL . 31.8 mttt -131.74 91.51 3.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.951 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -70.1 134.49 48.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.763 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.582 HG13 ' HB2' ' A' ' 148' ' ' ALA . 22.0 t -133.65 116.86 25.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.079 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.64 ' C ' HD22 ' A' ' 125' ' ' LEU . 5.1 m -62.46 164.5 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.984 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.777 HD23 ' HA ' ' A' ' 38' ' ' ALA . 4.4 mm? -124.48 33.55 5.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.911 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -145.33 35.93 1.09 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.891 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.5 tpt -178.67 -37.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.994 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.12 -169.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.306 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.537 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.4 OUTLIER -167.87 122.85 1.0 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.537 179.894 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.69 HG12 HD12 ' A' ' 176' ' ' ILE . 2.2 p -98.61 159.31 3.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.288 0.565 . . . . 0.0 111.525 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.473 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 12.5 m -162.94 157.7 21.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.743 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.412 ' HB3' ' NH1' ' A' ' 132' ' ' ARG . 12.7 ttp-105 -140.09 117.95 11.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.956 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.831 179.843 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 2.0 t80 . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.858 0.361 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.786 HD21 ' HB2' ' A' ' 169' ' ' ALA . 7.1 mt -120.39 126.51 50.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.793 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -134.53 132.16 38.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.885 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.547 HD13 HG21 ' A' ' 172' ' ' ILE . 18.5 mt -129.49 125.8 62.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.128 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 30.4 p -104.74 130.96 52.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.738 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -110.18 147.31 33.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.167 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.97 30.57 2.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.306 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -115.74 45.29 1.73 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.191 0.519 . . . . 0.0 110.139 179.433 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 118.68 22.16 3.73 Favored Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.191 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.41 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.0 mm-40 58.74 61.65 2.13 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 121.14 0.495 . . . . 0.0 110.826 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.738 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 4.6 m-20 -88.12 158.96 18.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.802 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -157.21 85.44 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.191 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.455 HG12 ' HD2' ' A' ' 121' ' ' LYS . 4.7 m -80.0 123.82 37.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.192 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -105.91 106.54 17.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.644 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.607 ' CB ' HD22 ' A' ' 12' ' ' LEU . 2.1 mt -119.85 160.85 21.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.151 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.423 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 22.5 ttt180 -132.46 107.74 8.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.764 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.983 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -58.68 173.05 0.44 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.228 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.02 -29.4 14.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.888 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -123.66 143.99 49.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.906 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -45.96 82.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.962 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.71 -39.94 88.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.007 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 68.4 m -61.91 -48.92 78.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.686 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.983 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -59.52 -39.75 84.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.031 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 5.0 mtt85 -69.9 -46.71 64.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.41 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.5 t -64.51 -33.23 75.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.219 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.774 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -72.93 -51.25 19.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.845 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.786 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -55.72 -56.26 22.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.309 0.576 . . . . 0.0 110.516 179.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.41 -36.85 78.79 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.752 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -71.84 -39.86 69.46 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.157 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.547 HG21 HD13 ' A' ' 146' ' ' ILE . 7.4 mt -63.58 -22.2 30.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.606 -0.886 . . . . 0.0 108.606 177.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.577 ' N ' HG11 ' A' ' 130' ' ' VAL . 1.2 tp60 -77.76 -40.88 39.45 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.483 179.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.49 -33.05 75.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.766 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . 0.408 ' HB3' HD12 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -82.58 -29.39 30.29 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.09 179.268 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.69 HD12 HG12 ' A' ' 130' ' ' VAL . 17.2 mt -71.59 -27.75 29.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.691 179.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 0.288 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.612 179.739 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo . . . . . 0 C--O 1.231 0.146 0 CA-C-O 120.779 0.241 . . . . 0.0 112.356 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.491 ' HD2' HD23 ' A' ' 34' ' ' LEU . 4.3 ptp180 -112.93 135.69 53.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.868 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.4 p -124.61 168.44 13.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.966 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.55 126.71 1.25 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.47 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.502 HD22 ' HD3' ' A' ' 29' ' ' ARG . 10.5 mt -59.68 128.05 35.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.843 0.354 . . . . 0.0 110.932 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.853 HD21 HD12 ' A' ' 144' ' ' LEU . 0.2 OUTLIER -145.48 140.68 27.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.806 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.95 154.93 37.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.939 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 16.1 tp -134.73 130.96 37.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.452 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.506 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 2.6 ttp180 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.801 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.506 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 43.0 m95 . . . . . 0 CA--C 1.529 0.147 0 CA-C-O 120.738 0.304 . . . . 0.0 111.02 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -153.17 158.08 41.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.095 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.502 ' HD3' HD22 ' A' ' 11' ' ' LEU . 1.5 ttm180 -82.34 123.56 29.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.946 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.682 HG12 ' HA ' ' A' ' 43' ' ' PRO . 20.5 m -143.31 123.22 9.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.209 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 11' ' ' LEU . 1.0 OUTLIER -69.85 134.85 48.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.613 179.762 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.84 121.85 41.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.979 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.2 t -100.37 86.0 3.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.694 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.501 HD12 ' CG ' ' A' ' 39' ' ' LEU . 1.7 tp -80.27 129.65 34.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.028 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.655 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -135.26 138.67 43.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.06 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.72 -23.69 44.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.037 0.446 . . . . 0.0 111.285 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -88.83 -30.15 19.16 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.929 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.655 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -175.41 173.01 2.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.032 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.501 ' CG ' HD12 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -114.71 129.01 56.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.942 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.496 ' CG2' ' HB1' ' A' ' 120' ' ' ALA . 28.6 m -128.33 129.65 46.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.752 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.461 HG12 ' N ' ' A' ' 42' ' ' SER . 13.9 t -107.28 159.02 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.317 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.461 ' N ' HG12 ' A' ' 41' ' ' VAL . 11.3 t -159.59 149.0 14.46 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.451 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.682 ' HA ' HG12 ' A' ' 30' ' ' VAL . 66.7 Cg_endo -75.07 43.03 0.92 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.654 2.236 . . . . 0.0 113.23 -179.663 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.237 0 CA-C-O 120.939 0.399 . . . . 0.0 111.846 179.594 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.496 ' HB1' ' CG2' ' A' ' 40' ' ' THR . . . . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.748 0.308 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 94.11 6.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.803 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -86.33 104.54 15.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.996 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.2 t -108.19 139.89 28.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.039 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.9 152.21 19.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.961 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.423 HD13 ' HB2' ' A' ' 39' ' ' LEU . 4.8 tp -131.95 31.47 4.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.903 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.95 41.74 2.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.724 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 174.88 -32.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.914 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.32 -171.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.378 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -161.23 107.1 1.38 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.587 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.599 HG11 ' N ' ' A' ' 173' ' ' GLN . 1.6 p -80.23 158.64 4.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.233 0.539 . . . . 0.0 111.359 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.472 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.4 OUTLIER -160.48 150.04 17.53 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.646 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.5 ptt85 -124.0 111.48 16.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.086 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.816 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 1.9 t80 . . . . . 0 CA--C 1.527 0.059 0 CA-C-O 120.74 0.305 . . . . 0.0 110.829 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.853 HD12 HD21 ' A' ' 12' ' ' LEU . 91.4 mt -96.2 139.88 31.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.918 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -148.1 130.02 15.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.729 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 14.8 mt -130.89 123.26 53.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.295 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 60.1 m -108.42 119.38 39.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.667 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -100.11 143.14 30.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.377 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.58 30.89 2.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.167 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -121.35 47.8 1.78 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.381 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 125.69 18.7 2.39 Favored Glycine 0 CA--C 1.519 0.292 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.524 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.95 60.93 2.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.973 0.416 . . . . 0.0 110.925 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -93.44 152.94 18.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.713 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -160.49 86.88 0.74 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.085 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 155' ' ' VAL . 35.5 m -84.12 124.83 40.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.111 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -109.47 102.47 11.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.904 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.0 mt -113.67 167.99 10.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.136 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.452 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 5.5 ttt-85 -144.4 97.6 3.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.702 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 1.049 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.69 171.28 0.22 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.423 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.42 -30.54 13.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.029 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -105.97 164.83 11.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.893 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -79.98 -65.31 1.02 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.958 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -60.04 -26.79 66.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.151 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 4.5 t -68.96 -43.49 74.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.908 0.385 . . . . 0.0 110.282 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 1.049 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -73.31 -28.23 61.97 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.544 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 11.1 ptt85 -79.28 -40.48 30.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.429 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.3 t -70.95 -31.76 68.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.108 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.487 ' O ' HD12 ' A' ' 172' ' ' ILE . 9.9 m95 -71.51 -47.4 55.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.854 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.424 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -58.17 -48.95 78.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.263 0.554 . . . . 0.0 110.465 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.45 -42.48 95.85 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.581 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.89 -40.76 75.47 Favored 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 120.854 -0.338 . . . . 0.0 110.746 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.56 ' C ' HG11 ' A' ' 130' ' ' VAL . 11.8 mt -61.11 -23.12 28.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.599 ' N ' HG11 ' A' ' 130' ' ' VAL . 1.2 tt0 -77.74 -42.1 35.41 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.618 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.82 -43.68 92.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.487 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 74.6 mm-40 -67.28 -37.23 83.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.074 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.404 HD13 HG22 ' A' ' 172' ' ' ILE . 0.1 OUTLIER -59.8 -33.27 51.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.694 179.494 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.593 179.973 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.79 0.246 . . . . 0.0 112.309 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -110.61 144.85 38.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.739 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.667 HG22 ' HA ' ' A' ' 33' ' ' SER . 18.2 p -133.32 164.03 28.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -158.08 118.64 0.84 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.338 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.853 HD22 ' HD3' ' A' ' 29' ' ' ARG . 17.8 mt -59.44 93.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.843 0.354 . . . . 0.0 110.913 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.812 HD13 HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -96.32 170.04 9.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.787 -179.994 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -110.94 146.93 35.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.964 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 14.6 tp -125.37 142.99 51.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.738 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.478 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.697 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.478 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 12.1 m95 . . . . . 0 C--O 1.233 0.197 0 CA-C-O 120.77 0.319 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -65.95 178.97 0.97 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.136 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.853 ' HD3' HD22 ' A' ' 11' ' ' LEU . 3.8 tmm_? -117.92 110.82 18.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.824 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.839 HG12 ' HA ' ' A' ' 43' ' ' PRO . 29.0 m -113.96 138.44 43.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.157 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.0 tp -83.69 127.42 33.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.561 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.828 HD12 HG13 ' A' ' 41' ' ' VAL . 2.6 mp -98.16 101.28 12.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.119 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.667 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.7 OUTLIER -86.45 94.03 9.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.648 179.735 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.523 HD12 HD11 ' A' ' 39' ' ' LEU . 2.1 tp -87.69 129.81 35.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.992 -179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -135.72 140.07 44.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.972 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.7 -23.09 49.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.072 0.463 . . . . 0.0 111.251 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -86.47 -30.85 21.71 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.93 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.546 ' HA ' HD22 ' A' ' 125' ' ' LEU . . . -178.16 -178.66 0.67 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.99 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.523 HD11 HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -113.37 157.6 21.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.922 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.667 HG23 ' CD2' ' A' ' 122' ' ' HIS . 24.7 m -158.24 128.02 5.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.626 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.828 HG13 HD12 ' A' ' 32' ' ' LEU . 10.7 t -119.78 157.97 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.012 0.434 . . . . 0.0 111.348 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.452 ' N ' HG12 ' A' ' 41' ' ' VAL . 12.5 t -160.1 157.57 25.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.406 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.839 ' HA ' HG12 ' A' ' 30' ' ' VAL . 7.0 Cg_exo -73.85 39.56 0.52 Allowed 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.732 2.288 . . . . 0.0 112.973 -179.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.177 0 CA-C-O 121.018 0.437 . . . . 0.0 111.404 -179.999 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.694 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.786 0.327 . . . . 0.0 111.071 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.572 ' HD2' HG11 ' A' ' 155' ' ' VAL . 18.1 mttm -121.07 108.86 14.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.897 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.667 ' CD2' HG23 ' A' ' 40' ' ' THR . 14.1 m80 -109.92 144.63 38.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.949 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.643 HG13 ' HB2' ' A' ' 148' ' ' ALA . 4.0 t -123.39 127.32 74.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.869 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 56.4 p -58.27 -30.19 66.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.231 -179.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.546 HD22 ' HA ' ' A' ' 38' ' ' ALA . 2.1 mp 65.05 31.01 11.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.928 0.394 . . . . 0.0 110.832 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.18 36.12 3.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.716 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.588 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 1.5 mtp 170.01 -28.85 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.896 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -51.32 -177.86 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.976 0.417 . . . . 0.0 111.574 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -165.08 115.97 1.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.514 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.574 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -89.66 158.61 2.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.287 0.565 . . . . 0.0 111.487 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -167.92 128.08 1.34 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.707 -179.947 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.27 112.21 24.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.083 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.762 179.925 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 . . . . . 0 CA--C 1.527 0.077 0 CA-C-O 120.785 0.326 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.567 HD21 ' N ' ' A' ' 169' ' ' ALA . 1.1 mt -83.32 88.93 6.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.878 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -96.51 137.81 35.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.965 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.793 HD13 HG21 ' A' ' 172' ' ' ILE . 25.2 mt -141.46 126.76 18.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.035 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 63.8 m -114.22 130.6 56.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.049 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.643 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -112.15 152.03 28.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.103 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.588 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.87 30.96 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.356 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -111.03 42.41 1.64 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.336 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.22 26.79 1.96 Allowed Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.354 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 57.59 59.24 3.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.106 0.479 . . . . 0.0 111.006 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' ASP . . . . . 0.443 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 0.7 OUTLIER -90.13 152.3 21.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.774 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.13 94.23 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.056 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.572 HG11 ' HD2' ' A' ' 121' ' ' LYS . 10.8 m -95.76 132.98 38.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.169 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.449 ' CD1' ' N ' ' A' ' 156' ' ' PHE . 0.7 OUTLIER -119.06 98.77 6.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.897 179.918 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.58 HD13 HD21 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -106.02 167.92 9.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.937 -179.922 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' ARG . . . . . 0.446 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.9 OUTLIER -129.46 107.34 9.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.776 179.976 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.789 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -59.39 173.45 0.51 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.15 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.23 -30.14 16.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.039 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -122.53 157.78 31.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.929 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.09 -42.62 69.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.062 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.7 76.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.98 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 60.4 p -63.9 -44.26 93.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.653 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.789 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -62.84 -43.86 97.68 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.923 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.67 -42.4 77.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.484 179.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 91.1 p -66.57 -34.67 78.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.2 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 168' ' ' TRP . . . . . 0.491 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 12.1 m95 -73.0 -50.13 24.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.785 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . 0.567 ' N ' HD21 ' A' ' 144' ' ' LEU . . . -56.31 -51.13 69.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.271 0.557 . . . . 0.0 110.592 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.73 -41.31 95.79 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.71 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.41 -41.33 80.6 Favored 'General case' 0 CA--C 1.511 -0.544 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.141 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.873 HG22 HD12 ' A' ' 176' ' ' ILE . 7.0 mt -62.41 -23.38 32.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 173' ' ' GLN . . . . . 0.574 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.4 OUTLIER -79.97 -30.73 39.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.353 179.286 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -66.36 -47.03 74.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.423 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -71.05 -37.02 72.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.234 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 176' ' ' ILE . . . . . 0.873 HD12 HG22 ' A' ' 172' ' ' ILE . 70.3 mt -83.33 -5.95 9.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.373 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.321 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.321 179.828 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.798 0.332 . . . . 0.0 110.988 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.5 m -153.58 78.53 1.14 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.857 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.29 148.07 3.61 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.476 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.48 -40.95 3.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.867 0.365 . . . . 0.0 110.924 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.0 tpp85 -65.46 90.72 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.828 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.16 136.3 23.7 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.101 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.17 158.73 51.45 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.496 2.13 . . . . 0.0 112.281 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.5 ttm-85 -82.56 130.25 35.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.559 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.805 HG22 ' HA ' ' A' ' 33' ' ' SER . 21.7 p -120.65 146.37 46.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.971 0.415 . . . . 0.0 111.224 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -134.73 127.69 4.54 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.465 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' A' ' 11' ' ' LEU . 8.1 mt -69.82 101.24 1.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.944 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.812 HD13 HD22 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -121.23 164.2 17.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.717 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.688 ' O ' HD23 ' A' ' 157' ' ' LEU . 0.9 OUTLIER -89.55 163.79 15.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.959 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.452 ' HB2' HG21 ' A' ' 30' ' ' VAL . 18.1 tp -137.53 124.67 21.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.665 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.48 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 33.8 ttt180 -69.52 169.16 13.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.657 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 13.9 t -169.63 41.66 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.827 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -125.35 30.42 4.52 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.515 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.33 121.43 12.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.765 0.317 . . . . 0.0 111.123 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -167.41 -67.53 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.53 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.3 t -169.93 -68.46 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.758 0.313 . . . . 0.0 110.835 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.03 -145.54 2.04 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.532 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -151.25 30.58 0.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.807 0.337 . . . . 0.0 111.127 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -112.75 27.63 9.61 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.453 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -158.36 49.24 0.42 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.51 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -78.69 136.97 37.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.796 0.331 . . . . 0.0 110.959 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.8 50.39 1.35 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.814 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.48 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.4 m95 -48.98 168.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.167 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -166.63 141.61 4.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -64.2 136.04 56.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.007 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.452 HG21 ' HB2' ' A' ' 14' ' ' LEU . 31.6 m -146.36 169.98 5.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.12 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.478 HD23 ' HA ' ' A' ' 31' ' ' LEU . 0.7 OUTLIER -107.17 141.62 38.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.725 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 1.117 HD21 HD13 ' A' ' 157' ' ' LEU . 9.9 mp -114.54 82.84 1.79 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.901 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.805 ' HA ' HG22 ' A' ' 9' ' ' THR . 1.0 OUTLIER -69.95 88.9 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.58 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.109 HD12 HD23 ' A' ' 39' ' ' LEU . 1.7 tp -87.73 119.18 27.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.236 -179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -109.79 156.07 20.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.815 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -49.9 -22.82 1.64 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.793 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.444 ' HA ' HD12 ' A' ' 125' ' ' LEU . 3.6 p30 -152.87 38.14 0.51 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.204 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.564 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -175.2 119.92 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.957 0.408 . . . . 0.0 111.646 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.109 HD23 HD12 ' A' ' 34' ' ' LEU . 3.0 tm? -104.16 100.88 10.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.496 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.412 ' HG1' ' CE1' ' A' ' 122' ' ' HIS . 85.5 m -109.78 126.75 54.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.369 -179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.603 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 11.5 t -94.56 158.57 2.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.391 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.417 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -149.52 166.4 15.33 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.904 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -82.6 50.72 3.49 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.658 2.238 . . . . 0.0 112.46 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 49.23 30.33 3.05 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.188 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -141.79 179.6 6.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.021 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -109.89 176.34 19.2 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.473 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -94.73 131.04 31.45 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.506 0.193 . . . . 0.0 110.942 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.7 124.25 8.64 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.457 2.104 . . . . 0.0 112.349 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.21 -149.21 6.4 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.483 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.05 -8.03 22.7 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.639 2.226 . . . . 0.0 112.62 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -100.58 95.79 4.71 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-O 120.669 0.271 . . . . 0.0 110.871 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -68.76 164.31 33.84 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.493 2.129 . . . . 0.0 112.276 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.42 137.98 18.35 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.89 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -74.28 163.17 37.03 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.454 2.103 . . . . 0.0 112.298 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.486 ' HB1' ' O ' ' A' ' 109' ' ' SER . . . -60.65 176.18 0.4 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.049 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -116.4 128.14 55.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.876 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.8 mt -87.51 138.22 31.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.907 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -108.81 -63.11 1.38 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.902 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 117.17 -86.31 0.41 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.415 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -139.73 120.88 14.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.33 . . . . 0.0 111.044 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -154.21 102.62 2.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.15 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -94.46 152.05 39.77 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.851 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.19 135.46 52.78 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.487 2.125 . . . . 0.0 112.33 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 160.64 65.51 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.451 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.829 ' HB1' ' HG2' ' A' ' 68' ' ' PRO . . . -137.85 98.02 3.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.846 0.355 . . . . 0.0 111.153 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.734 ' HB3' ' HD3' ' A' ' 67' ' ' PRO . . . -87.02 -51.15 0.44 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.709 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.734 ' HD3' ' HB3' ' A' ' 66' ' ' ALA . 52.9 Cg_exo -52.13 -46.99 29.02 Favored 'Trans proline' 0 CA--C 1.529 0.238 0 C-N-CA 122.895 2.397 . . . . 0.0 112.958 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.829 ' HG2' ' HB1' ' A' ' 65' ' ' ALA . 90.3 Cg_endo -82.17 134.84 8.22 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.82 2.346 . . . . 0.0 112.308 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -138.79 117.68 12.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.967 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.1 mt -125.92 103.91 26.98 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.854 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.53 -166.32 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.452 2.102 . . . . 0.0 112.308 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.532 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.6 mt-10 67.21 72.58 0.35 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.334 0.587 . . . . 0.0 110.618 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.532 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 168.89 -43.34 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.562 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.537 ' H ' HD12 ' A' ' 74' ' ' LEU . 1.1 mp -89.52 -33.28 16.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.744 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.7 mp -65.87 -33.15 75.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.819 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.6 -46.02 15.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.772 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.488 ' NE2' HG21 ' A' ' 80' ' ' VAL . 4.7 mm-40 -95.16 55.25 1.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.949 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 3.7 ttp180 -92.25 -39.53 11.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.945 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -96.99 39.95 1.16 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.905 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.488 HG21 ' NE2' ' A' ' 77' ' ' GLN . 21.2 t -133.94 -44.76 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.155 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.472 ' N ' ' HD2' ' A' ' 82' ' ' PRO . 0.5 OUTLIER -56.54 -55.75 39.5 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.274 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.472 ' HD2' ' N ' ' A' ' 81' ' ' SER . 67.3 Cg_endo -76.07 58.88 5.71 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.893 2.395 . . . . 0.0 112.459 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 55.07 -168.92 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.153 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -164.34 166.59 20.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 71.12 -63.72 0.41 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.944 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -95.91 35.18 1.43 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.959 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -109.98 -31.26 7.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.837 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.13 151.45 47.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.103 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 132.45 99.34 0.73 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.556 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -91.89 68.14 2.04 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.572 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.426 HG23 ' N ' ' A' ' 92' ' ' SER . 8.1 t -136.59 -47.37 0.62 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.742 0.306 . . . . 0.0 110.867 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.426 ' N ' HG23 ' A' ' 91' ' ' THR . 47.2 t -147.93 173.48 12.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.933 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.577 HG22 ' O ' ' A' ' 93' ' ' VAL . 14.9 p 42.1 44.0 0.33 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.83 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.59 53.64 4.57 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.57 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 30.3 m0 -97.19 61.12 1.71 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.943 0.402 . . . . 0.0 110.757 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -100.26 35.29 2.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.848 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 52.7 p -124.72 75.26 64.53 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.97 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.92 108.19 0.37 Allowed 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.556 2.171 . . . . 0.0 112.319 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.99 -26.64 83.52 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.433 2.088 . . . . 0.0 112.012 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -120.58 -176.09 3.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.002 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.5 t -166.95 61.38 0.61 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.063 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.496 ' O ' HD22 ' A' ' 103' ' ' LEU . 73.1 Cg_endo -74.75 60.37 5.21 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.587 2.191 . . . . 0.0 112.351 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.496 HD22 ' O ' ' A' ' 102' ' ' PRO . 4.2 mm? -123.22 97.7 5.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.927 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -161.52 116.67 2.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.852 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.37 160.1 43.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.945 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.413 ' N ' ' HD3' ' A' ' 107' ' ' PRO . 2.2 tt0 59.22 63.12 3.74 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.056 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.413 ' HD3' ' N ' ' A' ' 106' ' ' GLN . 31.3 Cg_exo -58.8 -41.39 63.39 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.507 2.138 . . . . 0.0 112.078 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -158.72 124.92 4.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.771 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.486 ' O ' ' HB1' ' A' ' 55' ' ' ALA . 0.5 OUTLIER -179.5 -61.53 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.995 -179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.435 ' CD ' ' CB ' ' A' ' 109' ' ' SER . 56.2 Cg_endo -71.65 -167.17 0.28 Allowed 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.865 2.377 . . . . 0.0 112.326 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -131.09 65.87 0.59 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.65 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -57.71 -160.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.568 2.179 . . . . 0.0 112.16 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -127.57 78.04 75.27 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -52.36 92.56 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.606 2.204 . . . . 0.0 112.273 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.97 116.59 33.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.831 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -166.07 -56.58 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.862 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.47 -31.44 9.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.779 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.9 t 62.61 -80.99 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.028 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.51 141.15 33.77 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.913 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.603 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -58.99 179.61 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.084 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.59 82.8 2.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.928 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.412 ' CE1' ' HG1' ' A' ' 40' ' ' THR . 14.5 m-70 -76.18 135.62 39.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.829 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.558 HG11 ' HB2' ' A' ' 148' ' ' ALA . 21.5 t -138.62 120.77 17.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.116 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 5.6 m -59.69 151.38 25.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.858 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 37' ' ' ASP . 59.7 mt -109.32 38.08 2.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.899 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.93 34.23 4.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.833 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.561 ' HB2' ' HB3' ' A' ' 149' ' ' ALA . 10.5 ptt? 179.3 -36.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.044 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.85 -176.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.379 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.699 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.0 OUTLIER -167.44 125.79 1.28 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.472 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.586 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.2 p -94.19 159.18 2.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 121.255 0.55 . . . . 0.0 111.406 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' HG22 ' A' ' 130' ' ' VAL . 34.4 p -157.85 134.89 10.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.86 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 9.8 ttm105 -96.15 95.64 8.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.874 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -83.28 -177.06 6.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.95 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -139.85 155.12 47.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.953 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -99.09 152.3 37.73 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.904 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.97 -28.56 60.04 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.538 2.159 . . . . 0.0 112.484 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.4 p -95.19 -45.74 7.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.106 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.0 t0 59.99 73.82 0.62 Allowed Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.806 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.31 -45.11 5.77 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.587 2.192 . . . . 0.0 112.307 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.428 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.5 OUTLIER -174.88 -63.06 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.869 179.786 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.428 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 60.9 Cg_endo -72.68 119.25 5.98 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.522 2.148 . . . . 0.0 112.276 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 3.5 mmt180 -61.11 161.91 8.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.887 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -86.42 142.09 28.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.9 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.564 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.2 OUTLIER -121.0 140.55 51.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.794 179.892 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.435 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 6.0 tm-20 -148.68 126.49 11.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.826 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.782 HD11 HD13 ' A' ' 172' ' ' ILE . 29.6 mt -126.41 118.51 51.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.161 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 7.8 m -99.56 138.15 37.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.814 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.626 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -114.24 149.07 36.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.219 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.561 ' HB3' ' HB2' ' A' ' 127' ' ' MET . . . -95.14 30.4 2.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.286 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -115.23 45.03 1.71 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.186 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.3 22.73 3.37 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.132 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.407 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.6 mm-40 58.1 61.06 2.45 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.17 0.51 . . . . 0.0 110.968 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.626 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.1 m-20 -87.43 157.67 19.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.911 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -156.47 90.93 1.2 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.119 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 7.3 m -84.61 118.66 32.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.233 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.435 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 70.2 m-85 -106.18 116.19 31.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.749 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 1.117 HD13 HD21 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -127.18 160.58 30.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.03 -179.742 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.457 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 5.2 tmm_? -135.78 94.11 3.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.811 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 1.023 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -54.92 172.35 0.11 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.366 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.07 -32.66 11.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.885 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -98.32 162.39 13.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.931 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.46 -51.64 6.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.955 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -69.07 -30.62 68.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 20.2 m -67.66 -52.84 33.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.652 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 1.023 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -61.34 -35.83 78.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.976 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -43.62 54.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.491 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 5.1 m -67.75 -30.15 69.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.046 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.575 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 5.4 m95 -71.28 -50.95 27.35 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.972 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.564 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -56.09 -51.52 67.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.325 0.583 . . . . 0.0 110.575 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -56.81 -41.03 90.63 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.58 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.21 -40.58 77.91 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.842 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.787 HG22 HD12 ' A' ' 176' ' ' ILE . 18.3 mt -60.07 -24.68 30.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.586 ' N ' HG11 ' A' ' 130' ' ' VAL . 4.2 tt0 -82.52 -28.35 31.14 Favored 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.255 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.11 -49.67 69.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.116 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -68.74 -41.07 79.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.75 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.787 HD12 HG22 ' A' ' 172' ' ' ILE . 91.7 mt -76.79 -7.55 10.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.282 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -86.13 25.52 6.88 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.481 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.5 t . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.866 179.998 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.809 0.338 . . . . 0.0 111.014 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -172.23 151.69 2.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.756 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 72.42 80.46 0.4 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.6 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.74 -174.59 2.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.714 0.293 . . . . 0.0 110.902 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.78 155.55 49.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.934 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.32 108.59 40.03 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.008 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.04 158.52 57.56 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.382 2.055 . . . . 0.0 112.284 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -79.39 141.04 37.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.775 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.8 p -139.17 138.8 37.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.058 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -146.18 127.25 2.72 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.418 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.2 mt -59.03 103.99 0.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.775 0.322 . . . . 0.0 110.985 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.467 HD22 ' CB ' ' A' ' 157' ' ' LEU . 0.1 OUTLIER -103.2 170.13 8.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.723 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -114.66 151.64 33.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.003 0.43 . . . . 0.0 111.123 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.408 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 1.2 tp -137.48 142.38 41.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.407 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.583 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.54 -178.07 1.35 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.887 0.375 . . . . 0.0 110.891 -179.547 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.9 t -174.16 103.77 0.11 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.985 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -106.12 -71.37 0.79 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.544 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 61.77 154.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.845 0.355 . . . . 0.0 111.118 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.5 -136.18 13.28 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.506 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.75 -67.54 0.85 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 0.0 110.854 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 173.55 39.48 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.459 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.35 163.87 21.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.812 0.339 . . . . 0.0 111.2 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -73.57 65.87 1.7 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.476 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -127.34 36.0 2.68 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.493 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -60.23 95.63 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.844 0.354 . . . . 0.0 110.782 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -92.14 77.66 5.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.898 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.583 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 12.8 m95 -59.42 95.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.829 179.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.85 179.11 6.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.907 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.4 ttp180 -112.32 133.41 54.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.895 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.85 HG12 ' HA ' ' A' ' 43' ' ' PRO . 27.7 m -139.54 120.91 15.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.206 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.9 tp -71.53 128.99 37.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.596 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.423 HD12 HG13 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -95.27 132.16 40.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.026 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -108.97 84.97 2.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.778 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.3 tp -82.0 108.88 15.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.997 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -118.58 146.39 44.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.022 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -61.5 -16.24 45.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.485 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -95.3 -25.51 16.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.994 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.437 ' HA ' HD22 ' A' ' 125' ' ' LEU . . . -179.07 178.52 0.73 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.917 0.389 . . . . 0.0 111.089 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.533 ' HB2' HD13 ' A' ' 125' ' ' LEU . 0.2 OUTLIER -123.07 113.12 18.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.801 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 56.5 m -116.8 134.16 55.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.942 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.474 HG12 ' N ' ' A' ' 42' ' ' SER . 11.1 t -115.8 159.77 15.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.17 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.474 ' N ' HG12 ' A' ' 41' ' ' VAL . 6.2 t -155.56 157.8 31.67 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.553 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.85 ' HA ' HG12 ' A' ' 30' ' ' VAL . 3.1 Cg_exo -75.24 44.43 1.2 Allowed 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.943 2.429 . . . . 0.0 112.725 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 45.28 30.04 0.62 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.917 0.389 . . . . 0.0 111.348 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -71.85 127.22 31.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.998 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -73.88 -159.25 5.94 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.499 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.09 122.47 81.34 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 120.506 0.193 . . . . 0.0 110.854 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.29 115.68 2.54 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.421 2.081 . . . . 0.0 112.375 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.43 ' N ' ' HD3' ' A' ' 50' ' ' PRO . . . -177.6 62.08 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.524 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.43 ' HD3' ' N ' ' A' ' 49' ' ' GLY . 24.3 Cg_exo -63.22 148.71 92.83 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.696 2.264 . . . . 0.0 112.261 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.408 ' CB ' ' CD ' ' A' ' 52' ' ' PRO . 9.8 mm-40 -83.54 -62.33 0.28 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.0 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.408 ' CD ' ' CB ' ' A' ' 51' ' ' GLU . 72.9 Cg_endo -76.46 160.75 35.12 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.461 2.107 . . . . 0.0 112.361 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -153.02 89.82 3.64 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.907 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.35 -172.91 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.566 2.177 . . . . 0.0 112.309 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -140.23 99.29 3.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.089 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 59.5 105.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.921 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -134.65 152.39 51.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.828 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -97.5 -45.77 6.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 138.03 153.43 6.27 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.414 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -79.96 152.55 29.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.775 0.321 . . . . 0.0 111.149 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -97.63 129.76 44.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.181 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -71.41 146.82 92.26 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.898 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.88 146.59 35.75 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.474 2.116 . . . . 0.0 112.343 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -113.76 -30.19 2.65 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.528 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -138.88 94.01 2.77 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.766 0.317 . . . . 0.0 111.037 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.423 ' HB1' ' HD2' ' A' ' 67' ' ' PRO . . . -151.77 156.88 34.59 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.023 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.423 ' HD2' ' HB1' ' A' ' 66' ' ' ALA . 56.0 Cg_endo -70.5 140.23 39.41 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.541 2.161 . . . . 0.0 112.246 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.39 76.27 3.6 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.451 2.101 . . . . 0.0 112.322 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -95.76 162.39 13.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.0 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.491 HD13 ' HD2' ' A' ' 71' ' ' PRO . 0.1 OUTLIER -82.0 111.35 26.26 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.804 179.911 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.491 ' HD2' HD13 ' A' ' 70' ' ' LEU . 43.5 Cg_endo -67.71 -168.6 0.19 Allowed 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.373 2.049 . . . . 0.0 112.445 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.515 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.3 mt-10 66.09 72.07 0.4 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.506 0.67 . . . . 0.0 110.762 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.515 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 170.64 -47.19 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.784 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.445 ' N ' HD12 ' A' ' 74' ' ' LEU . 8.2 mp -92.61 -31.4 15.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.9 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.611 ' C ' HD12 ' A' ' 75' ' ' LEU . 3.3 pp -73.76 -27.19 61.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.119 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.423 ' N ' HD12 ' A' ' 75' ' ' LEU . 0.8 OUTLIER -56.93 -30.78 64.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.911 -179.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.38 -27.72 63.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.81 -30.13 63.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.96 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -98.2 31.88 2.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.886 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.6 t -136.67 -64.66 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.044 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 61.91 151.74 0.1 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.926 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.49 58.36 5.17 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.605 2.204 . . . . 0.0 112.42 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -178.57 38.1 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.913 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -78.48 112.76 15.87 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.954 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -158.64 93.83 1.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.882 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -98.1 -32.44 11.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.853 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.02 150.29 36.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.853 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 63.81 130.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.081 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 65.26 170.64 2.79 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.497 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 132.81 149.3 6.16 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.477 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.7 t -95.67 157.29 15.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.867 0.365 . . . . 0.0 110.85 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 60.51 21.56 11.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.135 0.493 . . . . 0.0 111.214 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.554 ' O ' HG13 ' A' ' 93' ' ' VAL . 14.2 p -84.61 116.1 27.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.185 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 166.88 -86.12 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.484 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 60.46 97.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.836 0.351 . . . . 0.0 110.815 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -139.49 36.26 2.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.905 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.2 t -165.86 87.8 0.92 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.914 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -68.81 111.1 2.52 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.566 2.177 . . . . 0.0 112.289 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -79.64 -27.33 4.14 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.582 2.188 . . . . 0.0 112.226 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -147.53 124.54 11.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.106 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.4 p -73.79 158.14 86.46 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.876 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.55 106.54 0.15 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.599 2.199 . . . . 0.0 112.212 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 37.9 mt -99.02 -34.73 10.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -148.6 -178.63 6.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.929 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -120.0 -42.71 2.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.925 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -176.46 83.14 0.27 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.48 85.2 0.58 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.524 2.149 . . . . 0.0 112.357 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.5 m 62.2 118.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.959 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.43 ' CB ' ' CD ' ' A' ' 110' ' ' PRO . 0.4 OUTLIER 179.48 -60.75 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.904 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.43 ' CD ' ' CB ' ' A' ' 109' ' ' SER . 69.7 Cg_endo -75.15 142.9 27.96 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.909 2.406 . . . . 0.0 112.3 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -146.92 149.34 21.47 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.495 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.4 91.18 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.615 2.21 . . . . 0.0 112.223 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.465 ' N ' ' HD2' ' A' ' 114' ' ' PRO . 17.2 mm-40 -69.3 -55.81 9.36 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.105 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . 0.465 ' HD2' ' N ' ' A' ' 113' ' ' GLN . 73.6 Cg_endo -77.17 176.15 10.47 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.964 2.443 . . . . 0.0 112.33 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -140.7 31.81 1.84 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.924 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -75.17 -66.56 0.75 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.875 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.412 HD12 ' O ' ' A' ' 117' ' ' LEU . 4.2 pp -160.78 139.75 10.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.907 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -132.27 159.13 39.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.899 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 59.78 22.12 10.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.12 0.486 . . . . 0.0 111.14 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . 61.44 172.39 0.11 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.071 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.56 88.64 2.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.922 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 14.8 m-70 -85.8 139.53 31.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.062 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.47 HG12 ' H ' ' A' ' 125' ' ' LEU . 11.2 t -122.87 120.87 61.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.882 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.99 -28.31 16.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.317 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.533 HD13 ' HB2' ' A' ' 39' ' ' LEU . 1.2 tp 62.69 -174.38 0.15 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.754 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt 57.54 37.2 27.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.835 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.72 ' HG2' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -178.99 -36.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.925 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.631 ' HB3' HG13 ' A' ' 176' ' ' ILE . . . -56.08 -169.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.071 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.4 ' HA ' HG21 ' A' ' 176' ' ' ILE . 13.1 t80 -161.89 116.56 1.93 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.956 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.589 HG11 ' C ' ' A' ' 172' ' ' ILE . 1.4 p -97.08 158.69 3.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.184 0.516 . . . . 0.0 111.154 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.2 m -163.88 156.41 17.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.84 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 19.7 ttp-105 -122.54 93.67 4.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.978 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -123.93 169.57 11.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.72 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . 0.446 ' C ' HG22 ' A' ' 135' ' ' THR . 6.6 p -110.89 -177.91 3.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.955 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.662 HG23 ' CD ' ' A' ' 136' ' ' PRO . 0.5 OUTLIER -167.22 -63.19 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.939 179.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . 0.662 ' CD ' HG23 ' A' ' 135' ' ' THR . 33.3 Cg_endo -67.46 -68.3 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.114 1.876 . . . . 0.0 112.45 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 3.4 t 178.17 42.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.856 0.36 . . . . 0.0 110.704 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -55.04 107.5 0.89 Allowed Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.954 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -63.49 -66.86 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.5 2.133 . . . . 0.0 112.462 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.462 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 3.9 mm-40 -96.36 -66.06 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.532 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.462 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 58.9 Cg_endo -72.19 -167.41 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.241 1.96 . . . . 0.0 112.417 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.6 mtt85 -152.58 175.11 13.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.82 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.405 ' CE1' ' HD2' ' A' ' 158' ' ' ARG . 3.4 m-30 -82.97 119.77 24.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.937 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.808 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.5 OUTLIER -90.33 98.75 11.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.655 179.862 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.401 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 8.3 tm-20 -102.74 132.09 49.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.976 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.514 HG12 HG21 ' A' ' 172' ' ' ILE . 5.1 mp -135.74 111.58 12.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.906 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.5 m -100.6 134.09 44.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.873 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.754 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -108.11 145.31 34.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.283 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.72 ' HB3' ' HG2' ' A' ' 127' ' ' MET . . . -96.56 31.55 2.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.104 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -125.35 50.1 1.83 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.283 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 126.13 14.61 2.98 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.663 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 61.06 62.93 1.33 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.063 0.459 . . . . 0.0 110.896 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.754 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 81.0 m-20 -92.15 151.84 20.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.758 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.447 ' HB1' ' CE1' ' A' ' 156' ' ' PHE . . . -157.8 91.81 1.16 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.069 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 155' ' ' VAL . 14.0 m -94.36 115.73 33.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.301 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.447 ' CE1' ' HB1' ' A' ' 154' ' ' ALA . 8.8 m-85 -105.21 89.59 3.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.554 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.467 ' CB ' HD22 ' A' ' 12' ' ' LEU . 1.1 mt -104.88 167.96 9.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.302 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.469 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 14.7 ttt-85 -127.43 103.16 7.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.616 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.909 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.01 173.57 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.294 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -77.49 -69.54 0.53 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.068 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -110.25 177.6 4.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.04 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.85 -42.65 66.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.011 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -63.75 -50.86 67.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.982 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -46.58 88.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.591 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.909 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -61.29 -37.4 83.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.962 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.4 -47.9 58.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.443 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 56.3 m -64.7 -33.1 75.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.067 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.456 ' O ' HD12 ' A' ' 172' ' ' ILE . 11.7 m95 -73.61 -50.8 19.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.712 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.808 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -57.15 -46.48 82.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.286 0.565 . . . . 0.0 110.474 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -60.49 -43.09 99.18 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.768 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.82 -40.37 72.48 Favored 'General case' 0 CA--C 1.509 -0.615 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.805 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.765 ' O ' HD13 ' A' ' 176' ' ' ILE . 11.8 mt -60.95 -23.73 30.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.561 ' N ' HG11 ' A' ' 130' ' ' VAL . 17.7 tt0 -78.87 -40.69 31.78 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.481 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . 0.456 ' HA ' HG22 ' A' ' 178' ' ' THR . . . -64.5 -46.18 84.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.43 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.07 -39.01 89.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.023 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.765 HD13 ' O ' ' A' ' 172' ' ' ILE . 1.2 mp -60.07 -36.05 65.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.592 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 129.9 56.05 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.46 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . 0.509 ' OXT' HG23 ' A' ' 178' ' ' THR . 4.4 t . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.035 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.808 0.337 . . . . 0.0 111.075 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.23 178.84 5.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.844 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 127.51 57.48 0.13 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.495 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -156.74 -61.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.829 0.347 . . . . 0.0 110.913 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -151.85 127.16 9.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.926 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -148.25 136.26 11.13 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.085 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.19 159.36 49.97 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.508 2.139 . . . . 0.0 112.386 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -85.41 140.91 30.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.634 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.727 HG22 ' HA ' ' A' ' 33' ' ' SER . 70.4 p -137.24 147.28 45.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.849 0.357 . . . . 0.0 111.191 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -152.55 123.16 1.41 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.356 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 35.0 mt -56.39 102.87 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.829 0.347 . . . . 0.0 111.03 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.872 HD13 HD22 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -112.63 151.65 29.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.716 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -95.23 146.58 24.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.873 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.447 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 14.8 tp -125.03 142.94 51.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.45 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.481 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 19.1 ttp180 -69.41 160.66 30.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.576 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.406 ' HB3' ' CB ' ' A' ' 26' ' ' ARG . 33.7 t -143.4 38.82 1.4 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.917 0.389 . . . . 0.0 110.984 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -157.51 27.47 0.48 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.492 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -110.33 57.01 0.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.061 0.457 . . . . 0.0 111.114 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -122.8 -61.15 0.2 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.497 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m -153.85 134.21 13.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.786 0.327 . . . . 0.0 110.955 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 90.62 -145.23 17.83 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.513 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -173.58 147.33 1.41 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.836 0.35 . . . . 0.0 111.048 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.76 41.34 3.14 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.49 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.01 51.72 0.54 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.46 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -70.36 121.11 17.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.859 0.362 . . . . 0.0 111.015 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.406 ' CB ' ' HB3' ' A' ' 16' ' ' CYS . 40.9 mtp180 -141.46 47.42 1.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.803 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.481 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.8 m95 -49.14 115.03 1.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.148 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -97.97 178.65 5.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.983 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.4 HH11 ' HB1' ' A' ' 44' ' ' ALA . 2.0 tmm_? -105.94 129.95 53.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.845 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.733 HG12 ' HA ' ' A' ' 43' ' ' PRO . 32.6 m -144.46 123.51 6.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.358 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.5 tp -69.72 120.96 16.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.503 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 1.009 HD12 HG13 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -88.12 109.2 19.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.962 -179.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.727 ' HA ' HG22 ' A' ' 9' ' ' THR . 44.1 t -85.01 84.43 7.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.688 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.673 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 4.1 tp -78.74 125.9 30.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.306 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -129.95 141.65 50.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.928 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -63.03 -14.8 52.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.52 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -101.8 -19.89 15.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.108 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.518 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -173.5 172.08 3.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.878 0.37 . . . . 0.0 111.068 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.451 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -121.66 107.86 12.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.809 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -113.69 141.4 47.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.155 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 1.009 HG13 HD12 ' A' ' 32' ' ' LEU . 2.5 t -118.41 152.92 20.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.012 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.4 t -149.05 149.93 31.02 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.541 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.733 ' HA ' HG12 ' A' ' 30' ' ' VAL . 60.4 Cg_endo -72.69 47.5 1.19 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.582 2.188 . . . . 0.0 112.838 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.4 ' HB1' HH11 ' A' ' 29' ' ' ARG . . . 45.19 30.09 0.6 Allowed 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.9 0.381 . . . . 0.0 111.408 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -121.4 108.08 13.25 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.025 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -91.6 143.23 16.46 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.486 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 43.19 84.37 0.19 Allowed Pre-proline 0 N--CA 1.464 0.243 0 CA-C-O 120.705 0.288 . . . . 0.0 111.403 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.9 125.26 13.9 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.51 2.14 . . . . 0.0 112.334 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -141.25 100.34 0.26 Allowed Glycine 0 CA--C 1.52 0.346 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.406 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -50.06 161.04 1.12 Allowed 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.612 2.208 . . . . 0.0 112.396 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -154.68 139.51 11.83 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.847 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.38 88.71 0.98 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.578 2.185 . . . . 0.0 112.278 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -60.7 160.51 19.07 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.933 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.59 125.83 18.31 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.613 2.209 . . . . 0.0 112.223 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.83 129.6 42.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.246 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 58.92 29.75 19.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.936 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.51 ' N ' HD12 ' A' ' 57' ' ' LEU . 6.7 mp 58.62 166.45 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.931 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -100.31 99.3 9.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.971 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 115.1 166.97 15.24 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.431 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.83 -171.56 0.1 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.789 0.328 . . . . 0.0 111.129 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -137.37 152.06 49.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.207 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.631 ' HB2' ' HB2' ' A' ' 66' ' ' ALA . 10.8 pt-20 43.59 64.28 6.96 Favored Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.508 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.423 ' HD3' ' N ' ' A' ' 62' ' ' GLU . 21.4 Cg_exo -65.32 142.86 74.65 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.615 2.21 . . . . 0.0 112.218 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.44 -80.37 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.699 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -116.08 174.46 6.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.849 0.357 . . . . 0.0 111.24 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.631 ' HB2' ' HB2' ' A' ' 62' ' ' GLU . . . -154.21 69.18 6.11 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.975 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.28 105.88 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.719 2.279 . . . . 0.0 112.399 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -71.87 100.91 1.12 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.418 2.078 . . . . 0.0 112.28 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -142.06 159.72 41.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.975 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 90.7 mt -60.14 163.23 8.46 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.963 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.425 ' HB3' HD11 ' A' ' 75' ' ' LEU . 35.4 Cg_exo -59.38 -154.23 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.489 2.126 . . . . 0.0 112.249 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.561 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 1.9 mt-10 66.03 71.32 0.41 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.389 0.614 . . . . 0.0 110.746 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.561 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 165.18 -35.03 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.415 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.3 pp -96.24 -33.99 11.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.834 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.425 HD11 ' HB3' ' A' ' 71' ' ' PRO . 4.2 mp -66.66 -26.46 67.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.04 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.745 HD22 ' O ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -94.25 -47.1 6.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.542 -179.974 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.725 ' N ' HD13 ' A' ' 76' ' ' LEU . 5.5 mt-30 -80.41 80.97 6.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.863 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -98.91 -60.14 1.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.727 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -98.28 60.07 1.38 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.86 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.5 t -138.7 -47.06 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.046 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.485 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -66.0 -49.98 54.52 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.177 179.943 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 81' ' ' SER . 45.2 Cg_endo -93.45 -141.15 0.02 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 123.664 2.909 . . . . 0.0 111.708 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.426 ' H ' ' HB2' ' A' ' 82' ' ' PRO . 35.3 t80 -121.64 130.41 53.46 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.83 0.347 . . . . 0.0 110.917 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -173.35 87.73 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.824 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.92 -53.32 2.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.887 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -139.62 94.47 2.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.944 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -105.28 136.36 44.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.897 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -123.52 -43.22 2.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.074 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 130.67 -164.56 23.05 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.537 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -145.38 -45.02 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.497 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.8 t -67.4 160.91 26.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.753 0.311 . . . . 0.0 110.943 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.9 m -115.77 141.41 48.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.952 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.2 p -65.92 142.21 17.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.078 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 101.06 -34.01 5.98 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.479 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.4 m95 -114.48 65.07 0.67 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.888 0.375 . . . . 0.0 110.872 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -173.21 50.59 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.808 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.8 t -155.2 111.88 2.28 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.783 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -68.21 157.13 63.12 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.428 2.085 . . . . 0.0 112.319 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.21 -27.59 24.12 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.597 2.198 . . . . 0.0 112.347 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -106.93 98.57 8.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.074 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 25.0 m -93.9 154.41 40.81 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.93 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.94 167.06 25.76 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.619 2.213 . . . . 0.0 112.261 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -104.42 82.91 1.98 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.923 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 58.01 104.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.971 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 4.8 ttt85 -151.91 154.96 37.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.85 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.6 142.33 24.41 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.866 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -55.89 -166.41 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.39 2.06 . . . . 0.0 112.345 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -150.41 33.57 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.811 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 87.4 p -108.53 125.24 32.26 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.873 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.31 -167.88 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.433 2.089 . . . . 0.0 112.339 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 64.56 115.98 0.01 OUTLIER Glycine 0 CA--C 1.519 0.302 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.471 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.94 -177.11 0.41 Allowed 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.452 2.101 . . . . 0.0 112.431 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -81.09 142.95 52.05 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.865 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.89 59.81 5.88 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.539 2.159 . . . . 0.0 112.262 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 59.0 ttp180 -147.1 157.59 43.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.84 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -158.32 50.76 0.4 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.864 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.418 HD22 ' HD3' ' A' ' 43' ' ' PRO . 0.5 OUTLIER -162.43 -44.16 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.983 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 26.5 t 62.89 -80.98 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.991 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.0 134.3 33.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.833 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.96 -175.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.995 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.506 ' HE2' HG12 ' A' ' 155' ' ' VAL . 6.3 mttp -131.79 82.99 2.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.009 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -82.49 150.87 26.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.961 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.497 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 18.7 t -150.37 159.34 4.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.022 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.499 ' O ' HD22 ' A' ' 125' ' ' LEU . 0.7 OUTLIER -82.2 171.54 14.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.048 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.518 HD23 ' HA ' ' A' ' 38' ' ' ALA . 0.7 OUTLIER -134.63 31.54 3.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.825 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.41 ' HD2' HG21 ' A' ' 178' ' ' THR . 0.2 OUTLIER -148.82 41.91 0.94 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.909 179.91 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.5 ttm 178.89 -36.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.939 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.12 -165.96 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.251 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.479 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.1 OUTLIER -168.61 137.76 2.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.66 -179.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.623 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -110.25 158.89 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.314 0.578 . . . . 0.0 111.484 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 1.3 m -163.67 151.43 12.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.473 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 11.8 ptt-85 -123.57 91.76 3.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.879 0.371 . . . . 0.0 111.171 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -81.83 175.15 10.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.703 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 1.1 t -135.52 147.87 48.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.832 0.348 . . . . 0.0 111.016 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 73.3 p -119.96 154.22 55.38 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.823 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -54.54 -22.69 28.91 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.56 2.173 . . . . 0.0 112.449 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 22.0 p -88.46 -37.61 15.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.839 0.352 . . . . 0.0 111.179 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -79.29 112.63 29.89 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.992 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -88.76 -72.73 0.0 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 122.796 2.331 . . . . 0.0 112.421 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.411 ' N ' ' HD2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER -73.43 -62.33 1.22 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.175 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' A' ' 140' ' ' GLU . 29.9 Cg_endo -63.58 173.5 4.43 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.513 2.142 . . . . 0.0 112.332 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -141.03 158.6 43.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.985 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -79.82 101.41 8.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.89 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.565 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.4 OUTLIER -76.29 105.07 7.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.891 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.425 ' HG3' ' CZ ' ' A' ' 156' ' ' PHE . 0.1 OUTLIER -111.0 130.66 55.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.629 HD11 ' CD1' ' A' ' 172' ' ' ILE . 24.5 mt -129.98 115.63 34.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.075 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 2.9 m -95.2 136.7 35.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.953 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.574 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -116.83 148.58 41.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.175 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.59 30.55 1.98 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.357 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.27 44.51 1.68 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.114 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 118.84 22.2 3.66 Favored Glycine 0 N--CA 1.452 -0.282 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.107 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 58.89 62.05 1.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.123 0.487 . . . . 0.0 110.818 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.574 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 1.2 m-20 -90.63 162.27 15.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.882 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.21 94.21 0.81 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.069 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.506 HG12 ' HE2' ' A' ' 121' ' ' LYS . 32.9 m -87.07 120.23 36.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.328 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.425 ' CZ ' ' HG3' ' A' ' 145' ' ' GLU . 0.3 OUTLIER -104.18 90.03 3.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.75 179.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.482 ' CB ' HD22 ' A' ' 12' ' ' LEU . 1.2 mt -102.75 168.96 8.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.961 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -137.44 103.35 5.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.838 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 1.054 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -57.53 173.49 0.27 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.5 tttp -79.86 -71.41 0.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.989 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -85.08 170.89 12.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.873 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -81.04 -35.56 31.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.948 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -73.33 -40.14 64.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.953 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.11 -41.4 90.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.43 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 1.054 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -64.76 -42.97 94.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.767 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.9 mtt180 -70.43 -43.97 68.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.225 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -34.53 77.84 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.327 0.584 . . . . 0.0 109.502 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.673 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -68.68 -59.83 2.84 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.595 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.565 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -47.13 -57.61 4.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.161 0.505 . . . . 0.0 110.881 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.46 -39.0 58.97 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.438 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -67.66 -41.61 83.51 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.152 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.927 HG22 HD12 ' A' ' 176' ' ' ILE . 12.7 mt -62.0 -23.29 31.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 177.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.623 ' N ' HG11 ' A' ' 130' ' ' VAL . 7.0 tt0 -81.17 -28.55 34.95 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.265 179.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.92 -45.12 75.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.375 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . 0.441 ' HB2' HD11 ' A' ' 125' ' ' LEU . 18.7 mt-30 -74.87 -34.44 62.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.188 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.927 HD12 HG22 ' A' ' 172' ' ' ILE . 82.8 mt -85.77 -7.36 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.33 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -85.85 25.09 6.95 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.515 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . 0.41 HG21 ' HD2' ' A' ' 126' ' ' LYS . 2.6 t . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.919 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 120.936 0.398 . . . . 0.0 111.048 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -71.65 174.49 6.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.861 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -170.46 -83.06 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.517 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.59 -74.05 0.62 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.811 0.338 . . . . 0.0 110.851 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.82 147.01 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.918 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -101.48 142.63 24.99 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.015 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -63.83 152.34 81.12 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.626 2.218 . . . . 0.0 112.272 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -84.15 152.53 24.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.943 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.756 HG22 ' HA ' ' A' ' 33' ' ' SER . 70.7 p -142.55 142.91 32.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.95 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -150.75 132.0 3.75 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.415 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.71 HD22 ' HD3' ' A' ' 29' ' ' ARG . 11.4 mt -64.84 119.45 10.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.871 0.367 . . . . 0.0 111.04 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 157' ' ' LEU . 0.1 OUTLIER -134.33 158.8 42.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.787 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.63 ' O ' HD23 ' A' ' 157' ' ' LEU . 1.4 mm-40 -92.5 157.75 16.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.969 0.414 . . . . 0.0 110.985 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.4 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 14.3 tp -134.81 130.29 35.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.659 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.488 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 12.9 ttp180 -69.57 168.86 13.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.655 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 26' ' ' ARG . 9.2 t -143.37 157.4 44.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.901 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 140.18 -100.25 0.27 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.54 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 60.96 179.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.834 0.349 . . . . 0.0 111.122 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.27 86.1 1.55 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.737 -0.745 . . . . 0.0 112.513 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.2 t -166.1 83.8 0.3 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.856 0.36 . . . . 0.0 110.867 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 90.37 -72.11 2.01 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.514 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -154.48 155.74 35.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.909 0.385 . . . . 0.0 111.052 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -134.48 70.0 0.52 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.415 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -94.39 23.21 33.03 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.669 -0.776 . . . . 0.0 112.644 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 60.41 112.18 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.802 0.334 . . . . 0.0 111.014 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.449 ' HD3' ' HG2' ' A' ' 72' ' ' GLU . 10.2 ttp-105 -140.95 65.0 1.41 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.84 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.488 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 32.7 m95 -50.41 173.9 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.994 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -169.28 166.78 10.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.875 0.369 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.71 ' HD3' HD22 ' A' ' 11' ' ' LEU . 7.6 tmm_? -90.81 130.5 36.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.853 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.713 HG12 ' HA ' ' A' ' 43' ' ' PRO . 34.6 m -149.93 125.13 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.367 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 tp -69.8 135.1 49.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.625 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.552 ' HG ' HG22 ' A' ' 41' ' ' VAL . 1.3 mp -103.93 113.97 27.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.964 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.756 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.9 OUTLIER -86.71 81.14 8.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.766 179.861 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.63 HD12 HD21 ' A' ' 39' ' ' LEU . 3.6 tp -73.7 117.08 15.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.105 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.434 ' O ' HD22 ' A' ' 125' ' ' LEU . . . -121.97 138.95 54.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.964 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.88 -23.9 47.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.222 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.33 -31.93 22.74 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.975 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.428 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -172.67 174.22 3.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.205 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.63 HD21 HD12 ' A' ' 34' ' ' LEU . 1.2 mt -111.26 115.32 29.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.864 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 63.9 m -120.27 130.74 54.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.841 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.641 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 14.7 t -111.86 159.34 11.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.169 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.473 ' N ' HG12 ' A' ' 41' ' ' VAL . 6.0 t -155.65 153.34 26.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.495 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.713 ' HA ' HG12 ' A' ' 30' ' ' VAL . 13.7 Cg_exo -69.41 50.68 0.73 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.736 2.291 . . . . 0.0 112.695 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 43.66 30.62 0.38 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.875 0.369 . . . . 0.0 111.438 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.78 101.61 12.95 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.935 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -70.2 125.28 14.83 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.396 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 60.49 92.68 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 120.665 0.269 . . . . 0.0 110.806 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.64 178.8 2.48 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.45 2.1 . . . . 0.0 112.379 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -123.95 93.1 0.46 Allowed Glycine 0 CA--C 1.518 0.255 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.532 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -68.93 -12.25 33.92 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.636 2.224 . . . . 0.0 112.544 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.461 ' CB ' ' CD ' ' A' ' 52' ' ' PRO . 2.8 mt-10 -160.06 -65.69 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.922 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 51' ' ' GLU . 57.5 Cg_endo -71.0 -169.23 0.38 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.326 2.017 . . . . 0.0 112.188 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -119.17 122.74 29.31 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.804 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.71 115.2 4.2 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.351 2.034 . . . . 0.0 112.333 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.02 155.24 20.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.145 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -124.63 136.41 53.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.916 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.5 mt -87.54 130.19 34.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.911 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -144.4 104.27 4.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.864 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -105.97 -71.59 0.8 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.466 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -110.66 102.64 11.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.821 0.343 . . . . 0.0 111.02 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.1 163.03 20.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.166 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -86.57 108.16 16.82 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.914 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.95 95.85 0.43 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.491 2.128 . . . . 0.0 112.332 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -170.94 91.55 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.47 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -145.55 99.83 3.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.915 0.388 . . . . 0.0 111.029 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.827 ' HB3' ' HD3' ' A' ' 67' ' ' PRO . . . -72.97 -59.65 2.13 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.254 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.827 ' HD3' ' HB3' ' A' ' 66' ' ' ALA . 73.9 Cg_endo -76.32 137.01 18.41 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 122.867 2.378 . . . . 0.0 112.282 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 67' ' ' PRO . 35.6 Cg_exo -57.6 83.12 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.41 2.073 . . . . 0.0 112.248 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.06 154.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.946 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.817 HD13 ' HD2' ' A' ' 71' ' ' PRO . 0.2 OUTLIER -99.81 119.76 58.94 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.784 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.817 ' HD2' HD13 ' A' ' 70' ' ' LEU . 40.6 Cg_endo -66.86 -171.66 0.28 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.462 2.108 . . . . 0.0 112.39 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.577 ' HA ' HD11 ' A' ' 75' ' ' LEU . 1.2 mt-10 68.87 74.24 0.26 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.476 0.655 . . . . 0.0 110.836 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 168.33 -50.92 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.537 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.52 -35.37 15.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.63 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.72 HD12 ' N ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -66.13 -14.99 62.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.421 179.898 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.72 ' N ' HD12 ' A' ' 75' ' ' LEU . 0.1 OUTLIER -58.84 -30.73 67.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.844 0.354 . . . . 0.0 110.958 -179.943 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.509 ' HB3' HG21 ' A' ' 80' ' ' VAL . 36.5 mt-30 -77.82 64.12 3.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.812 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.37 -23.32 26.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.172 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -96.32 30.98 2.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.094 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.509 HG21 ' HB3' ' A' ' 77' ' ' GLN . 20.6 t -118.07 -29.34 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.387 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.453 ' N ' ' HD2' ' A' ' 82' ' ' PRO . 0.1 OUTLIER -54.86 -54.77 45.95 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.34 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' A' ' 81' ' ' SER . 73.0 Cg_endo -78.05 56.07 5.57 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 122.91 2.406 . . . . 0.0 112.647 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 61.32 123.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.157 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -171.14 102.67 0.21 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.848 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.54 70.17 0.64 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.817 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -135.29 129.75 34.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.859 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 32.8 t -130.61 -68.44 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.933 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 60.01 173.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.075 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 160.16 -51.96 0.36 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.47 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 65.69 -107.18 1.82 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.461 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.773 HG21 ' HA ' ' A' ' 99' ' ' PRO . 4.1 t -176.38 156.17 1.53 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.841 0.353 . . . . 0.0 110.928 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.3 p -138.47 139.95 39.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.836 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.45 ' O ' HG13 ' A' ' 93' ' ' VAL . 12.5 p -71.66 123.02 25.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.145 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -155.36 -55.54 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.454 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 41.8 p90 -109.35 41.01 1.73 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.853 0.359 . . . . 0.0 110.771 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.1 t70 61.78 35.45 16.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.934 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.45 129.91 45.53 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.861 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.58 131.35 14.71 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.481 2.121 . . . . 0.0 112.358 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.773 ' HA ' HG21 ' A' ' 91' ' ' THR . 61.0 Cg_endo -72.82 -25.6 16.68 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.385 2.057 . . . . 0.0 112.298 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.57 122.32 12.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.202 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 95.5 p -138.25 115.6 9.26 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.885 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -58.06 122.48 11.78 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.547 2.164 . . . . 0.0 112.298 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.7 mt -132.57 132.15 42.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.925 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -95.74 119.53 34.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.865 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -113.46 -32.32 6.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.062 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 63.66 89.1 0.11 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.866 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -51.56 -54.75 4.82 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.634 2.223 . . . . 0.0 112.391 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.3 m -59.66 -172.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.963 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.9 m 62.98 144.66 0.08 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.014 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.92 146.08 36.95 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.555 2.17 . . . . 0.0 112.349 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -109.6 -69.95 0.64 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.449 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.01 146.91 35.43 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.56 2.173 . . . . 0.0 112.288 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.16 89.43 0.11 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.813 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -68.49 -168.63 0.23 Allowed 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.538 2.159 . . . . 0.0 112.304 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 20.3 mtm180 -75.53 106.43 7.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.899 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.427 ' O ' ' CB ' ' A' ' 117' ' ' LEU . 24.7 m-80 -80.75 153.03 28.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.828 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.56 HD23 ' O ' ' A' ' 119' ' ' GLU . 0.2 OUTLIER 83.2 -38.5 0.08 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.561 -179.847 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 24.9 t 68.01 -72.13 0.1 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.801 0.334 . . . . 0.0 111.098 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.56 ' O ' HD23 ' A' ' 117' ' ' LEU . 29.3 tt0 -95.72 154.97 16.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.88 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.641 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -85.67 169.96 12.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.089 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.32 159.74 15.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.802 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -147.67 135.28 20.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.881 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.756 HG13 ' HB2' ' A' ' 148' ' ' ALA . 19.7 t -139.68 140.15 37.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.135 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.01 135.74 37.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.832 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.434 HD22 ' O ' ' A' ' 35' ' ' ALA . 3.2 mp -99.19 31.49 3.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.864 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.833 ' HG2' HG21 ' A' ' 178' ' ' THR . 6.3 mttm -139.41 38.12 2.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.739 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.737 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 2.3 mtt 179.27 -35.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.063 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.8 -165.97 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.322 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -170.04 113.67 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.665 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.576 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.0 p -88.14 158.8 3.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.322 0.582 . . . . 0.0 111.439 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 2.6 m -164.65 149.78 9.84 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.801 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 7.0 ptt85 -126.67 104.04 7.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.012 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.15 156.01 17.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.753 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 61.1 m -81.83 141.02 33.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.912 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.405 ' HB ' ' HD2' ' A' ' 136' ' ' PRO . 0.1 OUTLIER -76.23 170.34 16.52 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.759 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . 0.405 ' HD2' ' HB ' ' A' ' 135' ' ' THR . 70.3 Cg_exo -50.68 -27.88 21.0 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.618 2.212 . . . . 0.0 112.445 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -126.82 -43.9 1.68 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.957 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.1 81.97 0.23 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.879 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.92 -24.5 24.29 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.576 2.184 . . . . 0.0 112.418 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.427 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 1.5 mt-10 -175.31 -62.44 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.804 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 44.4 Cg_endo -68.07 178.49 3.5 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.463 2.108 . . . . 0.0 112.225 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 9.2 mtt-85 -123.59 152.59 41.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.888 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -73.97 100.92 3.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.949 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.469 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.8 OUTLIER -82.83 138.1 34.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.949 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.416 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.0 OUTLIER -153.66 139.91 18.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.82 179.952 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 24.9 mt -134.1 125.1 47.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.241 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.47 126.18 49.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.78 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.857 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -102.78 145.53 29.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.361 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.737 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -96.75 30.65 2.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.171 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -118.61 46.07 1.91 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.38 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.39 23.11 2.69 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.356 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.43 60.66 2.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.126 0.489 . . . . 0.0 110.94 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.857 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 0.6 OUTLIER -90.16 160.65 16.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.9 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.23 94.03 0.8 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.078 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 6.9 m -89.48 112.67 24.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.246 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.416 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 15.6 m-85 -97.2 115.99 28.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.731 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.63 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.4 mt -125.66 165.61 18.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.078 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.459 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.1 OUTLIER -140.43 96.81 3.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.748 179.863 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.951 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -57.33 162.88 2.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.203 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.98 -32.23 17.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.924 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -98.13 164.27 12.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.822 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -88.65 -55.8 3.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.91 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.81 85.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.159 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 1.8 t -63.97 -48.16 77.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.79 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.951 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -60.12 -38.61 83.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.011 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 74.3 mtp180 -71.12 -47.33 58.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.436 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.06 -28.4 69.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.176 179.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.6 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -72.44 -52.07 17.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.908 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.469 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -56.9 -47.62 80.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.304 0.573 . . . . 0.0 110.53 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.96 -43.12 97.04 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.64 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.95 -40.72 78.76 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.997 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.795 HG22 HD12 ' A' ' 176' ' ' ILE . 19.1 mt -60.21 -24.63 31.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.576 ' N ' HG11 ' A' ' 130' ' ' VAL . 30.6 tt0 -83.84 -27.0 29.03 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.324 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.56 -47.98 68.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.141 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -69.96 -42.09 73.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.86 179.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.795 HD12 HG22 ' A' ' 172' ' ' ILE . 75.9 mt -77.57 -8.94 12.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.36 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -85.89 25.67 6.57 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.393 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . 0.833 HG21 ' HG2' ' A' ' 126' ' ' LYS . 3.6 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.858 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.859 0.361 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -168.65 84.73 0.17 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.894 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.06 36.6 90.92 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.609 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -119.22 86.31 2.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.817 0.341 . . . . 0.0 110.957 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -68.45 102.86 1.52 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.864 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -110.13 92.6 13.48 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.166 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -68.09 152.87 76.09 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.584 2.19 . . . . 0.0 112.297 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.647 ' CG ' HD23 ' A' ' 34' ' ' LEU . 4.4 ptt180 -101.25 139.18 37.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.952 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.628 HG22 ' HA ' ' A' ' 33' ' ' SER . 14.0 p -129.36 167.98 16.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.02 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -167.05 132.75 2.7 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.48 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.5 103.22 0.63 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.762 0.315 . . . . 0.0 110.895 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -120.19 146.69 45.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.811 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.492 ' O ' HD23 ' A' ' 157' ' ' LEU . 4.1 mm-40 -70.64 169.84 13.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.922 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.422 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 37.6 tp -157.57 130.42 7.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.697 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.483 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.57 -171.65 0.4 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.635 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.6 t -178.29 101.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.905 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -150.87 -176.52 23.85 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.413 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -162.8 90.31 0.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.837 0.351 . . . . 0.0 111.092 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 128.93 -45.43 1.14 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.618 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.2 m -100.61 141.82 32.94 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.833 0.349 . . . . 0.0 110.838 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.92 -32.72 4.92 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.482 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -153.34 30.74 0.48 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.81 0.338 . . . . 0.0 111.089 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -120.53 33.46 4.47 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.472 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.16 104.95 2.96 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.471 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -140.07 174.84 10.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.768 0.318 . . . . 0.0 110.952 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.405 ' O ' ' CD1' ' A' ' 27' ' ' TRP . 0.2 OUTLIER -97.88 173.75 6.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.939 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.483 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 17.1 m95 -154.82 173.64 16.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.929 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -178.09 168.45 1.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.926 0.393 . . . . 0.0 110.844 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -95.09 129.02 42.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.866 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 27.7 m -136.65 138.39 46.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.177 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 17.4 tp -74.33 123.44 24.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.658 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.776 HD12 HG13 ' A' ' 41' ' ' VAL . 0.4 OUTLIER -98.04 114.49 26.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.108 -179.833 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.628 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.9 OUTLIER -94.47 85.74 4.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.575 179.657 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.732 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 2.5 tp -84.93 103.7 14.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.136 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.639 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -91.21 155.96 18.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.706 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -57.43 -16.73 10.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.816 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.06 28.95 1.1 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.432 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.69 ' CA ' HD23 ' A' ' 125' ' ' LEU . . . 179.55 114.75 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.858 0.361 . . . . 0.0 111.514 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.543 HD13 HD12 ' A' ' 34' ' ' LEU . 17.2 tp -95.92 82.44 3.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.397 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.489 HG21 ' CE1' ' A' ' 122' ' ' HIS . 27.6 m -92.49 114.19 26.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.204 -179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.776 HG13 HD12 ' A' ' 32' ' ' LEU . 8.0 t -83.41 157.35 3.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.675 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.411 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -159.9 163.09 23.42 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.906 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.455 ' HD3' HD22 ' A' ' 117' ' ' LEU . 56.0 Cg_endo -70.35 147.41 59.0 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.534 2.156 . . . . 0.0 112.133 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -95.83 43.56 1.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.984 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.3 p30 44.82 37.12 2.13 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.513 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -78.22 136.35 17.86 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.438 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -145.61 154.26 52.1 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.683 0.278 . . . . 0.0 110.91 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -62.16 179.03 0.67 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.528 2.152 . . . . 0.0 112.208 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.425 ' N ' ' HD2' ' A' ' 50' ' ' PRO . . . 168.75 -56.64 0.21 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.548 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' A' ' 49' ' ' GLY . 60.9 Cg_endo -72.98 -6.05 18.3 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.545 2.163 . . . . 0.0 112.694 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.55 96.36 4.45 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.833 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.94 111.85 2.54 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.409 2.073 . . . . 0.0 112.354 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -123.29 124.0 26.47 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.84 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.48 154.09 65.16 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.375 2.05 . . . . 0.0 112.325 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -149.48 -176.49 5.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.074 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.673 ' C ' HD23 ' A' ' 57' ' ' LEU . 0.9 OUTLIER 64.55 -78.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.945 179.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.673 HD23 ' C ' ' A' ' 56' ' ' GLN . 1.0 OUTLIER 42.44 43.93 3.28 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.508 179.897 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -62.65 113.07 2.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 153.07 97.24 0.15 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.521 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.29 96.45 9.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.83 0.348 . . . . 0.0 111.149 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -157.58 124.5 5.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.091 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 59.78 82.34 0.23 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.921 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.19 162.76 1.86 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.553 2.169 . . . . 0.0 112.289 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -176.34 -52.97 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.451 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -81.49 94.67 6.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.779 0.323 . . . . 0.0 111.064 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.861 ' HB3' ' HD3' ' A' ' 67' ' ' PRO . . . -114.8 -68.53 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.542 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.861 ' HD3' ' HB3' ' A' ' 66' ' ' ALA . 58.4 Cg_endo -72.24 111.41 3.19 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.751 2.301 . . . . 0.0 112.409 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.15 -161.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.495 2.13 . . . . 0.0 112.385 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.492 ' C ' HD22 ' A' ' 70' ' ' LEU . 45.7 mt-30 -96.2 176.25 6.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.079 179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.492 HD22 ' C ' ' A' ' 69' ' ' GLN . 4.4 mm? -118.66 83.82 23.11 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.942 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.5 -167.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.635 2.223 . . . . 0.0 112.275 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.489 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 1.3 mt-10 66.01 72.05 0.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.376 0.607 . . . . 0.0 110.801 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.489 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 172.06 -46.53 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.736 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.94 -31.34 17.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.775 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.585 ' H ' HD12 ' A' ' 75' ' ' LEU . 4.0 mp -74.27 -37.24 63.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.985 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.8 mp -61.15 -34.45 75.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.936 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 62.1 mm-40 -97.82 32.45 2.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.012 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -107.55 -0.2 22.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.421 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -98.29 31.96 2.63 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.82 0.343 . . . . 0.0 111.03 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 38.8 t -143.62 -72.13 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.152 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.6 t 61.72 148.32 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.912 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -83.44 48.38 2.64 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.69 2.26 . . . . 0.0 112.524 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -177.52 37.42 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.954 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.408 ' O ' ' CD1' ' A' ' 84' ' ' PHE . 52.9 p90 -74.64 123.14 24.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -114.15 171.17 7.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -108.95 92.99 4.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.906 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.2 p -167.74 173.17 8.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.859 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -81.09 151.82 28.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.124 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -155.53 36.57 0.63 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.412 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -152.16 123.73 1.52 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.492 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.5 t -178.81 -38.33 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.86 0.362 . . . . 0.0 110.996 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 64.98 122.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.875 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 9.6 p -87.86 151.26 3.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.184 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 156.06 44.13 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.524 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 10.9 t-105 62.66 85.32 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.818 0.342 . . . . 0.0 110.963 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.5 t70 62.66 30.88 16.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.133 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 48.8 p 54.1 101.04 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.199 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_exo -51.64 106.6 0.14 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.543 2.162 . . . . 0.0 112.315 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -78.16 -26.85 6.01 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.586 2.19 . . . . 0.0 112.401 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -142.99 144.06 32.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.177 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.462 ' CB ' ' HD3' ' A' ' 102' ' ' PRO . 0.5 OUTLIER 174.97 -54.53 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.028 179.853 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.462 ' HD3' ' CB ' ' A' ' 101' ' ' SER . 51.7 Cg_exo -52.09 147.96 25.5 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.826 2.351 . . . . 0.0 112.248 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.505 HD12 ' HB2' ' A' ' 104' ' ' GLN . 3.5 pp -178.17 -39.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.901 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.505 ' HB2' HD12 ' A' ' 103' ' ' LEU . 1.9 tt0 -111.53 109.01 18.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.879 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -158.39 87.27 0.89 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.88 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -82.81 131.87 53.13 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.907 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -73.56 146.14 38.63 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.506 2.137 . . . . 0.0 112.268 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.03 31.19 0.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.808 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.32 154.93 82.07 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.88 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -69.86 143.77 51.38 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.663 2.242 . . . . 0.0 112.309 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 96.5 144.95 18.18 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.418 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.13 174.24 0.18 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.527 2.151 . . . . 0.0 112.276 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -100.26 108.6 53.32 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.859 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -49.4 118.72 3.87 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.463 2.108 . . . . 0.0 112.417 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.77 83.82 1.35 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.808 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -74.2 139.66 44.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.917 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.455 HD22 ' HD3' ' A' ' 43' ' ' PRO . 3.5 tt 60.64 157.88 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.936 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 98.6 p -155.17 -45.81 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.979 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -104.06 148.13 26.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.887 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.488 ' HB3' ' NE2' ' A' ' 122' ' ' HIS . . . -73.06 163.66 27.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.224 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.431 ' HB2' HG23 ' A' ' 41' ' ' VAL . 2.0 mtpp -110.41 74.53 0.88 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.049 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.489 ' CE1' HG21 ' A' ' 40' ' ' THR . 19.6 m-70 -73.05 102.7 3.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.975 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.763 HG13 ' HB2' ' A' ' 148' ' ' ALA . 24.7 t -99.94 115.65 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.965 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 72.1 p -59.74 137.44 58.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.848 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.69 HD23 ' CA ' ' A' ' 38' ' ' ALA . 4.0 mm? -98.64 53.96 1.03 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.807 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 27.1 mttt -164.45 37.3 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.006 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.713 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -178.51 -39.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.38 . . . . 0.0 110.949 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.15 -169.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.149 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.675 ' HA ' HG21 ' A' ' 176' ' ' ILE . 13.6 t80 -170.11 123.48 0.71 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.495 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.569 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.5 p -94.66 157.65 3.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.492 0.663 . . . . 0.0 111.615 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.479 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -170.31 127.67 0.83 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.696 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 18.3 ptt-85 -83.26 96.49 8.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.947 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 30.3 mtt180 -94.48 -176.91 4.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.034 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.21 -175.33 3.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.775 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.584 HG23 ' CE1' ' A' ' 143' ' ' TYR . 0.1 OUTLIER -157.62 -55.1 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.234 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . 0.545 ' HD3' HG23 ' A' ' 135' ' ' THR . 1.0 OUTLIER -83.49 8.3 4.7 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.766 2.311 . . . . 0.0 112.508 -179.888 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . 0.423 HG23 ' C ' ' A' ' 136' ' ' PRO . 1.5 p 67.91 29.73 6.45 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.082 0.467 . . . . 0.0 110.456 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -109.36 92.75 12.09 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.883 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.59 78.36 1.66 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.443 2.095 . . . . 0.0 112.488 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.489 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.2 OUTLIER -152.86 -68.1 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.984 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.489 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 66.8 Cg_endo -73.2 -43.67 0.68 Allowed 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.193 1.929 . . . . 0.0 112.062 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? 62.74 124.51 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.008 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.584 ' CE1' HG23 ' A' ' 135' ' ' THR . 7.7 m-85 -80.96 114.86 20.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.777 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.544 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 2.0 mt -69.94 94.02 0.82 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.97 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -99.9 123.67 44.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.78 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.484 HD11 HD13 ' A' ' 172' ' ' ILE . 22.5 mt -128.81 120.8 53.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.212 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -101.91 129.74 48.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.775 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.763 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -110.98 146.46 36.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.192 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.713 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.1 30.84 2.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.283 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -114.95 44.92 1.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.062 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.93 20.93 3.3 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.692 -0.686 . . . . 0.0 112.249 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.411 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 4.5 mm-40 58.69 61.33 2.23 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.066 0.46 . . . . 0.0 110.949 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.604 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.4 m-20 -92.85 157.96 16.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.682 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -161.15 92.78 0.93 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.225 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.8 m -84.49 127.17 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.032 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -109.21 88.72 2.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.742 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.492 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.5 mt -95.95 153.57 17.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.901 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.457 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER -127.83 94.02 3.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.841 -179.893 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.992 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -58.24 143.53 44.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.123 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.07 -32.95 51.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.816 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.12 168.6 10.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.848 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -88.72 -61.3 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.878 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -59.7 -31.96 70.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.075 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -49.82 70.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.745 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.992 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -60.44 -41.87 94.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.183 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -71.33 -40.38 70.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.545 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 94.4 p -68.59 -33.89 74.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.097 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.732 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -74.28 -49.1 24.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.839 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.544 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -58.57 -49.76 76.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.328 0.585 . . . . 0.0 110.278 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.65 -42.02 96.0 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.425 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.18 -40.68 77.96 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.77 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.718 HG22 HD12 ' A' ' 176' ' ' ILE . 11.2 mt -60.33 -24.43 30.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.569 ' N ' HG11 ' A' ' 130' ' ' VAL . 6.3 tp60 -81.43 -29.88 33.7 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.008 -0.997 . . . . 0.0 110.069 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.79 -49.8 71.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.119 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.24 -42.14 84.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.713 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.718 HD12 HG22 ' A' ' 172' ' ' ILE . 80.5 mt -76.83 -5.55 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.42 179.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -87.13 26.12 7.17 Favored Glycine 0 C--N 1.332 0.359 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.454 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.144 -0.931 . . . . 0.0 110.963 -179.928 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.758 0.313 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.7 m -74.48 138.77 43.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.946 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -177.04 84.59 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.501 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 13.6 ttp85 -97.3 23.18 7.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.679 0.276 . . . . 0.0 111.096 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.89 92.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.927 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -136.24 131.17 18.55 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.041 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.91 129.63 11.7 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.512 2.141 . . . . 0.0 112.366 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.4 ttt85 -72.37 141.95 48.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.833 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 77.4 p -143.34 165.13 28.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.978 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 173.8 135.52 2.03 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.421 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.8 mt -68.62 122.36 18.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 0.0 110.935 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.494 HD22 ' HB3' ' A' ' 157' ' ' LEU . 0.1 OUTLIER -131.91 158.41 41.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.723 179.797 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.81 150.95 20.82 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.071 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.418 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 7.3 tp -134.29 137.54 44.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.577 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.532 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.7 -164.32 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.82 -179.717 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -159.78 129.67 5.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.759 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.536 ' O ' ' HB3' ' A' ' 18' ' ' ALA . . . 159.66 -25.39 0.32 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.565 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.536 ' HB3' ' O ' ' A' ' 17' ' ' GLY . . . 75.56 -68.45 0.2 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.895 0.379 . . . . 0.0 111.292 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.11 -140.34 3.21 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.592 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.6 m -57.66 137.45 56.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.323 . . . . 0.0 111.033 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 122.12 39.47 0.55 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.495 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.9 77.32 0.08 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.835 0.35 . . . . 0.0 111.168 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -123.99 43.38 1.42 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.464 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 171.09 -65.43 0.15 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.518 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 62.78 137.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.86 0.362 . . . . 0.0 110.871 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -149.33 73.96 1.22 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.023 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.532 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 24.7 m95 -54.42 108.77 0.41 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.902 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.16 152.54 24.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.065 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.97 135.01 37.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.982 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.644 HG12 ' HA ' ' A' ' 43' ' ' PRO . 33.0 m -148.25 125.75 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.26 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.8 tp -69.8 135.94 50.26 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.596 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.61 HD12 HG13 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -104.53 142.0 35.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.747 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.0 m -123.12 94.53 4.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.884 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.507 HD11 HG13 ' A' ' 172' ' ' ILE . 0.4 OUTLIER -85.55 96.81 9.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.815 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -107.63 137.8 45.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.951 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -57.1 -23.0 43.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.081 0.467 . . . . 0.0 111.226 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 89.9 m-20 -85.11 -31.1 23.52 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.722 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -175.79 168.76 3.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.021 0.439 . . . . 0.0 111.315 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.535 ' C ' HD13 ' A' ' 39' ' ' LEU . 3.2 tm? -111.0 108.77 18.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.417 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.561 HG23 ' CD2' ' A' ' 122' ' ' HIS . 8.3 m -114.2 139.23 49.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.254 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.61 HG13 HD12 ' A' ' 32' ' ' LEU . 16.8 t -117.46 159.69 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.881 179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.472 ' N ' HG12 ' A' ' 41' ' ' VAL . 3.1 t -156.34 152.55 23.36 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.708 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.644 ' HA ' HG12 ' A' ' 30' ' ' VAL . 60.0 Cg_endo -72.08 47.71 1.06 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.485 2.123 . . . . 0.0 112.485 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 50.75 29.25 4.12 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.118 0.485 . . . . 0.0 111.11 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -138.8 74.17 1.46 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.705 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -116.19 107.39 1.65 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.496 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -142.29 156.37 64.25 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 120.66 0.267 . . . . 0.0 110.939 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.56 163.85 33.31 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.507 2.138 . . . . 0.0 112.255 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.66 79.73 1.45 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.455 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.39 154.94 70.86 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.611 2.207 . . . . 0.0 112.277 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -148.96 100.41 3.44 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.852 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -49.24 132.86 29.31 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.507 2.138 . . . . 0.0 112.421 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -68.54 127.07 93.27 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.847 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.51 176.87 8.71 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.442 2.095 . . . . 0.0 112.302 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -84.12 158.34 21.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.121 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 60.85 165.49 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.36 -33.0 70.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.959 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -123.98 155.41 38.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.925 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.69 -81.07 1.12 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.517 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -102.73 103.15 13.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.835 0.35 . . . . 0.0 111.097 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.627 ' HB1' ' HD2' ' A' ' 63' ' ' PRO . . . 59.54 160.92 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.13 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.556 ' N ' ' CD ' ' A' ' 63' ' ' PRO . 2.1 mp0 -76.43 -43.07 3.29 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.486 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.627 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 51.6 Cg_exo -52.35 144.76 38.64 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.587 2.191 . . . . 0.0 112.306 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -138.85 34.84 2.05 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.797 -0.715 . . . . 0.0 112.577 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.75 115.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.816 0.341 . . . . 0.0 111.085 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 60.61 87.53 0.13 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.06 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -49.08 105.04 0.09 OUTLIER 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.658 2.239 . . . . 0.0 112.46 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.08 165.96 31.33 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.424 2.083 . . . . 0.0 112.301 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -89.15 135.36 33.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 70' ' ' LEU . 4.5 mm? -102.12 105.65 43.68 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.03 -174.02 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.34 2.027 . . . . 0.0 112.315 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.628 ' HA ' HD11 ' A' ' 75' ' ' LEU . 2.4 mt-10 64.56 70.93 0.48 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.39 0.614 . . . . 0.0 110.671 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 167.47 -45.52 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.536 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -93.54 -30.3 15.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.684 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.722 HD12 ' N ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -75.81 -15.27 60.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.508 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.722 ' N ' HD12 ' A' ' 75' ' ' LEU . 3.0 tp -70.94 -43.83 67.36 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.837 0.351 . . . . 0.0 110.867 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -69.44 -74.82 0.12 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.856 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 69.66 -64.64 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.111 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -94.84 36.15 1.21 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.19 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.5 t -144.64 -68.32 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.025 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.48 167.11 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.991 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -68.64 60.02 1.14 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.913 2.409 . . . . 0.0 112.286 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -159.38 31.88 0.2 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.016 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -128.08 -176.53 3.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.858 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.6 ttpp -93.37 -34.58 13.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -125.87 174.64 8.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.871 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.1 m -110.01 -72.66 0.71 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.904 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -87.25 -72.01 0.53 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.068 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 98.62 147.34 21.97 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.451 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 109.21 -115.13 4.19 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.454 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.3 t -143.72 133.57 23.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.864 0.364 . . . . 0.0 110.858 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.8 m -90.51 135.08 33.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.94 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.56 HG22 ' O ' ' A' ' 93' ' ' VAL . 12.4 p -91.32 49.62 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.087 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -116.14 27.78 7.97 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.546 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 7.6 m95 -114.37 31.21 6.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.921 0.391 . . . . 0.0 110.881 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -157.87 45.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.955 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.0 m -143.22 154.96 61.69 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.84 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -68.44 148.93 74.34 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.422 2.081 . . . . 0.0 112.363 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -77.7 59.14 6.7 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.489 2.126 . . . . 0.0 112.328 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -149.82 155.65 40.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.141 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -137.51 171.79 7.91 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.86 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_exo -51.11 171.92 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.541 2.161 . . . . 0.0 112.336 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.13 145.45 24.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.888 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -99.26 141.27 32.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.859 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -174.54 134.14 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.853 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.42 ' CB ' ' HD3' ' A' ' 107' ' ' PRO . 0.0 OUTLIER -87.75 -51.23 0.41 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.947 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.42 ' HD3' ' CB ' ' A' ' 106' ' ' GLN . 3.1 Cg_exo -74.83 108.97 2.83 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.716 2.277 . . . . 0.0 112.073 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 13.5 m -163.55 171.83 15.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.087 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -135.23 150.12 71.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.88 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.96 179.17 4.0 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.516 2.144 . . . . 0.0 112.417 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 174.37 -75.84 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.442 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.71 -166.23 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.604 2.203 . . . . 0.0 112.305 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.93 117.47 61.47 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.85 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.95 -172.89 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.447 2.098 . . . . 0.0 112.341 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.0 146.83 29.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.948 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 60.17 177.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.87 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 15.8 tp -96.91 102.94 14.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.909 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.7 p -103.36 -31.67 9.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.897 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -104.75 176.7 5.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.902 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.17 169.83 16.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.082 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.473 ' HE2' HG13 ' A' ' 155' ' ' VAL . 0.9 OUTLIER -129.3 91.18 3.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.91 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.561 ' CD2' HG23 ' A' ' 40' ' ' THR . 20.4 m80 -80.22 143.18 33.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.928 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.409 ' CG1' ' HB2' ' A' ' 148' ' ' ALA . 20.3 t -142.22 140.48 29.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.122 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.706 ' C ' HD22 ' A' ' 125' ' ' LEU . 1.4 m -76.74 158.52 30.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.722 HD23 ' HA ' ' A' ' 38' ' ' ALA . 3.7 mm? -123.18 43.66 2.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.939 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -142.82 35.73 1.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.846 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.779 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER 179.25 -36.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.954 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.85 -173.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.316 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.576 ' HA ' HG21 ' A' ' 176' ' ' ILE . 17.8 t80 -170.04 128.2 0.89 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.682 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.626 HG12 HD12 ' A' ' 176' ' ' ILE . 2.4 p -105.52 159.52 5.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.321 0.581 . . . . 0.0 111.493 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -165.46 134.22 3.27 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.78 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.4 ' NH1' ' NH2' ' A' ' 142' ' ' ARG . 2.4 ptt180 -99.59 91.88 5.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.098 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.85 -170.24 1.55 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.619 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 28.8 p -143.67 122.65 12.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.969 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 2.0 p -93.25 159.24 35.75 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.791 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.69 -6.05 18.31 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.587 2.191 . . . . 0.0 112.791 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 25.6 p -123.65 30.31 6.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.821 0.344 . . . . 0.0 110.933 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -135.97 79.58 44.56 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.923 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.72 -71.4 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.522 2.148 . . . . 0.0 112.357 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.412 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.4 OUTLIER -72.42 -61.51 1.74 Allowed Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.097 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.412 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 46.0 Cg_endo -68.6 170.1 15.87 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.393 2.062 . . . . 0.0 112.381 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.4 ' NH2' ' NH1' ' A' ' 132' ' ' ARG . 2.8 mtt180 -134.23 -178.5 5.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.903 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.433 ' CZ ' ' HB3' ' A' ' 156' ' ' PHE . 5.1 t80 -103.26 114.08 28.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.991 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.664 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.7 OUTLIER -95.6 114.63 26.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.852 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.412 ' HG3' ' CE1' ' A' ' 156' ' ' PHE . 43.3 tt0 -120.78 128.71 53.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.994 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 1.122 HD13 HG21 ' A' ' 172' ' ' ILE . 19.6 mt -132.3 110.03 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.168 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.27 122.54 40.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.806 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.605 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -105.45 146.57 29.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.24 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.779 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.31 30.47 2.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.261 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -115.06 44.95 1.7 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.076 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.54 23.45 2.58 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.17 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.409 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 6.2 mm-40 56.64 59.23 3.66 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.048 0.451 . . . . 0.0 110.978 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.605 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 6.6 m-20 -90.58 160.36 15.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.797 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -165.98 95.45 0.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.159 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.473 HG13 ' HE2' ' A' ' 121' ' ' LYS . 11.1 m -90.1 128.46 42.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.167 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.433 ' HB3' ' CZ ' ' A' ' 143' ' ' TYR . 20.9 m-85 -115.93 92.42 3.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.67 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.494 ' HB3' HD22 ' A' ' 12' ' ' LEU . 1.5 mt -98.61 168.18 10.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.128 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.467 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER -134.14 93.47 3.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.571 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 1.071 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.28 168.96 0.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.339 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -84.37 -67.27 0.81 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.959 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -90.28 164.57 14.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.943 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.99 -43.24 79.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.837 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -67.74 -32.54 73.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.077 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 62.2 m -66.28 -50.07 64.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.797 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 1.071 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -62.22 -37.51 85.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.911 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 15.0 ttt180 -72.74 -43.86 62.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.387 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.3 t -65.59 -32.9 74.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.945 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.425 ' CZ3' ' HB2' ' A' ' 34' ' ' LEU . 8.5 m95 -74.16 -53.15 10.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.691 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.664 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -58.08 -50.78 72.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.339 0.59 . . . . 0.0 110.388 179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.74 -38.38 91.84 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.554 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -71.29 -40.21 71.01 Favored 'General case' 0 CA--C 1.511 -0.545 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.999 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 1.122 HG21 HD13 ' A' ' 146' ' ' ILE . 8.4 mt -62.54 -22.7 30.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.572 ' N ' HG11 ' A' ' 130' ' ' VAL . 26.5 tt0 -77.35 -40.47 43.9 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.434 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . 0.407 ' HA ' ' CG2' ' A' ' 178' ' ' THR . . . -63.36 -37.53 87.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.471 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . 0.426 ' C ' HD12 ' A' ' 125' ' ' LEU . 4.7 mp0 -76.81 -33.08 58.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.187 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.626 HD12 HG12 ' A' ' 130' ' ' VAL . 48.1 mt -73.75 -28.92 25.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.809 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.468 ' O ' HG22 ' A' ' 178' ' ' THR . . . 151.12 -41.96 0.75 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.781 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . 0.468 HG22 ' O ' ' A' ' 177' ' ' GLY . 14.5 t . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.254 -0.879 . . . . 0.0 111.517 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.821 0.343 . . . . 0.0 111.076 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.1 -57.52 1.77 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.878 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -103.82 -137.75 9.47 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.491 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.93 -28.56 8.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.756 0.312 . . . . 0.0 110.958 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 60.93 97.22 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.848 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -136.43 102.28 9.75 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.097 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -67.85 135.52 35.61 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.444 2.096 . . . . 0.0 112.234 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.89 152.34 18.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.761 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.665 HG22 ' HA ' ' A' ' 33' ' ' SER . 6.9 p -146.13 158.07 43.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.997 0.427 . . . . 0.0 111.219 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -156.11 135.28 4.46 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.266 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 11' ' ' LEU . 12.9 mt -62.92 106.69 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.778 0.323 . . . . 0.0 110.911 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -117.03 170.07 8.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.865 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.613 ' O ' HD23 ' A' ' 157' ' ' LEU . 9.0 mt-10 -107.68 162.68 13.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.016 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.6 tp -137.1 129.66 30.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.553 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.482 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 37.9 ttp180 -69.54 165.07 21.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.874 0.369 . . . . 0.0 110.717 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.8 t -145.92 81.15 1.59 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.944 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -99.82 -72.84 1.03 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.493 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -84.86 73.96 10.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.874 0.369 . . . . 0.0 111.123 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -98.51 -65.87 0.87 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.504 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.3 t -111.08 -33.76 6.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.83 0.347 . . . . 0.0 110.828 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 166.41 -30.99 0.2 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.521 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -167.18 137.94 3.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.939 0.399 . . . . 0.0 111.073 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -153.82 -62.74 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.529 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 116.88 46.91 0.5 Allowed Glycine 0 N--CA 1.453 -0.202 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.535 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 61.25 84.6 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.697 0.284 . . . . 0.0 110.896 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.0 mmt85 -109.44 69.01 0.69 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.859 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.482 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 29.0 m95 -51.12 168.48 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.17 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -148.95 -166.72 2.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.882 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.0 ttp-105 -124.93 110.76 14.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.989 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.73 HG12 ' HA ' ' A' ' 43' ' ' PRO . 34.6 m -125.35 127.53 72.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.159 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.8 tp -76.04 115.53 15.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.409 HD13 HD22 ' A' ' 157' ' ' LEU . 0.4 OUTLIER -84.62 121.58 27.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.904 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.665 ' HA ' HG22 ' A' ' 9' ' ' THR . 17.7 m -103.61 86.84 2.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.647 HD13 HD13 ' A' ' 172' ' ' ILE . 14.7 tp -78.36 113.35 16.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.819 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -106.39 148.93 27.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.915 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -64.88 -11.71 40.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.712 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -134.84 16.6 3.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.314 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.633 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . 179.28 160.04 0.7 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.85 0.357 . . . . 0.0 111.265 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.65 ' HB2' HD21 ' A' ' 125' ' ' LEU . 66.5 tp -124.23 88.71 2.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.557 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.701 HG23 ' O ' ' A' ' 121' ' ' LYS . 79.4 m -94.29 145.31 24.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.158 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.497 HG12 ' N ' ' A' ' 42' ' ' SER . 21.2 t -125.65 160.21 32.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.019 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.497 ' N ' HG12 ' A' ' 41' ' ' VAL . 84.5 p -151.9 152.13 29.4 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.539 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.73 ' HA ' HG12 ' A' ' 30' ' ' VAL . 95.7 Cg_endo -78.93 37.68 0.68 Allowed 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.666 2.244 . . . . 0.0 112.852 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 46.6 29.19 0.89 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.076 0.465 . . . . 0.0 111.325 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.56 119.03 17.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.877 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -83.98 133.36 11.79 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.57 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -89.26 154.03 48.94 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.759 0.314 . . . . 0.0 110.94 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.2 163.25 38.54 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.523 2.148 . . . . 0.0 112.35 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -144.68 -149.61 5.07 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.505 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -51.84 104.64 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.604 2.203 . . . . 0.0 112.353 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 60.94 87.6 0.13 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.84 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.56 176.36 6.72 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.627 2.218 . . . . 0.0 112.253 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -141.7 70.02 25.16 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.85 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.82 -168.07 0.34 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.538 2.159 . . . . 0.0 112.357 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 62.44 118.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.066 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -105.57 162.61 13.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.917 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 57' ' ' LEU . 4.1 mm? -109.09 36.67 2.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.838 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -86.32 129.72 34.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.867 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -175.37 -105.31 0.19 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.514 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.4 179.53 5.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.811 0.338 . . . . 0.0 111.069 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -136.05 175.25 9.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.093 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -89.02 111.89 47.64 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.986 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -55.63 160.98 8.44 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.473 2.115 . . . . 0.0 112.274 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 107.53 -43.5 1.68 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.543 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.49 138.42 58.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.827 0.346 . . . . 0.0 111.104 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.681 ' HB1' ' HD2' ' A' ' 67' ' ' PRO . . . -61.61 165.02 8.07 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.044 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.681 ' HD2' ' HB1' ' A' ' 66' ' ' ALA . 57.3 Cg_endo -71.0 110.84 2.91 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.571 2.181 . . . . 0.0 112.323 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.66 -168.25 0.55 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.427 2.085 . . . . 0.0 112.316 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.7 129.13 36.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.82 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.2 mt -61.96 123.35 77.3 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.853 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.751 ' HA ' HD22 ' A' ' 75' ' ' LEU . 51.4 Cg_endo -69.09 178.24 4.35 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.452 2.102 . . . . 0.0 112.548 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.423 ' N ' HD13 ' A' ' 75' ' ' LEU . 3.1 pt-20 -157.68 53.06 0.47 Allowed 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.158 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 59.36 28.07 17.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.276 0.56 . . . . 0.0 110.15 -179.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.489 ' C ' HD23 ' A' ' 74' ' ' LEU . 10.3 tt -150.51 -48.6 0.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.979 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.751 HD22 ' HA ' ' A' ' 71' ' ' PRO . 7.1 mp -61.43 -38.04 85.69 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.786 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.1 tp -53.78 -46.57 71.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.119 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 14.4 mp0 -93.85 45.85 1.16 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.901 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.611 ' O ' HG23 ' A' ' 80' ' ' VAL . 38.8 ttt180 -110.3 129.69 55.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.914 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.2 31.51 20.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.985 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 78' ' ' ARG . 24.9 t -130.95 -57.54 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.061 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.423 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.1 OUTLIER -79.08 -54.2 1.04 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.736 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 81' ' ' SER . 88.7 Cg_endo -86.3 39.93 0.69 Allowed 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 123.194 2.596 . . . . 0.0 112.655 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER 179.41 134.18 0.09 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 59.7 43.06 16.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.85 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -118.08 -50.79 2.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.925 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -98.25 106.12 18.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.775 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 28.6 t -134.07 -68.81 0.55 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.849 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 59.49 -178.12 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.13 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 110.28 -66.4 0.24 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.526 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -129.61 106.74 0.75 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.513 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.472 ' O ' HG23 ' A' ' 91' ' ' THR . 11.2 t -99.88 116.25 31.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.824 0.345 . . . . 0.0 110.916 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.2 p -103.66 131.96 50.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.87 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.9 p -79.28 130.56 35.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.059 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -135.88 59.38 0.65 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.509 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER 62.34 99.53 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.853 0.358 . . . . 0.0 110.798 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -133.61 53.25 2.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.846 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.67 108.57 43.55 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.921 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.425 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 26.2 Cg_exo -62.85 120.51 8.04 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.544 2.163 . . . . 0.0 112.135 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 98' ' ' PRO . 26.9 Cg_exo -62.16 -26.05 77.57 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.457 2.105 . . . . 0.0 111.994 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -126.91 -173.99 3.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.087 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 73.0 m -97.67 112.44 61.43 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.804 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -51.53 -178.16 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.416 2.077 . . . . 0.0 112.34 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.2 mt 62.03 95.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.868 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.52 -168.83 2.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.881 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.23 43.21 1.11 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.967 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -151.1 70.41 8.46 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.875 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.85 164.76 34.68 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.566 2.177 . . . . 0.0 112.333 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.75 -176.43 0.11 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.014 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.56 166.19 7.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.957 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.19 157.54 56.98 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.644 2.23 . . . . 0.0 112.393 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.422 ' N ' ' HD3' ' A' ' 112' ' ' PRO . . . 57.95 62.55 6.18 Favored Glycine 0 CA--C 1.52 0.368 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.611 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.422 ' HD3' ' N ' ' A' ' 111' ' ' GLY . 20.4 Cg_exo -65.67 102.1 0.49 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.672 2.248 . . . . 0.0 112.327 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.553 ' HB2' ' HD3' ' A' ' 114' ' ' PRO . 2.2 mt-30 -135.73 -66.35 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.571 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . 0.553 ' HD3' ' HB2' ' A' ' 113' ' ' GLN . 86.9 Cg_exo -43.45 94.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.687 2.258 . . . . 0.0 112.51 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -114.53 92.48 3.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.107 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -91.57 116.34 28.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.7 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 61.67 82.46 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.691 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 5.7 t -63.75 -35.91 82.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.003 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.87 162.3 23.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.895 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.414 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -80.02 157.57 26.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.047 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.701 ' O ' HG23 ' A' ' 40' ' ' THR . 0.8 OUTLIER -88.44 160.31 17.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.914 179.923 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.405 ' CE1' ' O ' ' A' ' 120' ' ' ALA . 16.9 m80 -152.27 113.01 4.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.77 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.449 HG11 ' HB2' ' A' ' 148' ' ' ALA . 21.5 t -119.94 133.63 66.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.144 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 13.1 t -75.46 147.11 40.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.812 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.912 HD13 ' HB3' ' A' ' 175' ' ' GLN . 18.1 mt -104.2 38.08 1.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.043 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -128.59 34.29 4.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.792 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.798 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER 179.58 -35.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.009 179.989 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.56 -173.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.347 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -170.07 111.29 0.43 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.491 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.618 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -87.45 159.18 3.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.272 0.558 . . . . 0.0 111.406 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.466 ' N ' HG22 ' A' ' 130' ' ' VAL . 97.8 p -162.05 149.14 13.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.708 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.443 ' HD3' ' HB3' ' A' ' 169' ' ' ALA . 27.9 ptt85 -118.69 95.79 4.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.965 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -85.37 -167.58 1.89 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.847 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 6.2 p -124.61 156.22 37.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.913 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 60.4 p -121.37 145.98 43.74 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.804 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.7 -30.46 7.69 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.641 2.227 . . . . 0.0 112.337 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 26.1 p -73.6 -33.59 64.67 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.972 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.4 ' O ' ' HD2' ' A' ' 141' ' ' PRO . 0.2 OUTLIER -146.27 92.78 5.17 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.022 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -82.32 63.35 8.17 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.559 2.172 . . . . 0.0 112.281 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.747 ' HB2' ' HD3' ' A' ' 141' ' ' PRO . 54.4 mt-10 -157.51 -54.71 0.02 OUTLIER Pre-proline 0 CA--C 1.532 0.258 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.607 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.747 ' HD3' ' HB2' ' A' ' 140' ' ' GLU . 23.7 Cg_exo -64.41 -21.84 66.22 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.163 1.908 . . . . 0.0 112.129 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 61.97 151.9 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.962 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -94.0 115.21 27.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.9 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.776 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.9 OUTLIER -89.68 98.24 11.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.77 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -108.39 137.31 46.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.895 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.503 HD13 HG21 ' A' ' 172' ' ' ILE . 23.3 mt -137.27 108.81 6.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.144 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.3 m -92.51 135.37 34.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.864 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -113.12 144.9 41.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.187 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.798 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -94.55 30.9 1.88 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.304 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -121.44 48.17 1.72 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.129 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.28 18.77 3.68 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.375 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.417 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 4.8 mm-40 58.64 61.67 2.15 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.096 0.474 . . . . 0.0 111.021 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.864 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 1.2 m-20 -89.85 163.81 14.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.8 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.85 96.47 0.44 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.068 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.3 m -97.63 121.76 48.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.169 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 156' ' ' PHE . 0.5 OUTLIER -113.05 106.29 14.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.791 179.802 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.613 HD23 ' O ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -111.92 166.23 11.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.067 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.427 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -129.15 109.96 11.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.868 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.91 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -68.83 158.76 33.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.076 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -31.5 24.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.95 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -109.32 160.54 16.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.944 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -74.16 -61.78 1.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -58.99 -27.89 65.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.172 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 45.2 t -66.64 -48.43 69.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.699 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.91 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -62.12 -42.51 99.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.973 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 40.7 mtt180 -71.27 -40.81 70.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.449 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 32.6 t -67.66 -34.38 76.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.059 0.457 . . . . 0.0 109.939 179.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.445 ' O ' HG12 ' A' ' 172' ' ' ILE . 12.9 m95 -72.5 -52.49 15.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.67 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.776 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -56.53 -45.98 80.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.171 0.51 . . . . 0.0 110.465 179.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.61 -43.98 95.85 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.518 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.36 -40.8 77.26 Favored 'General case' 0 CA--C 1.511 -0.544 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.611 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.768 HG22 HD12 ' A' ' 176' ' ' ILE . 12.9 mm -58.67 -24.81 26.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.618 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -84.12 -28.62 27.36 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.2 179.216 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.42 -40.87 77.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.247 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . 0.912 ' HB3' HD13 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -75.14 -41.27 58.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.004 179.156 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.768 HD12 HG22 ' A' ' 172' ' ' ILE . 54.0 mt -79.9 -10.29 12.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.268 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -85.55 25.38 6.5 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.367 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . 0.418 HG22 ' O ' ' A' ' 175' ' ' GLN . 9.8 t . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.96 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.83 0.348 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.5 92.4 7.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.888 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -93.87 -154.49 31.09 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.551 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -108.05 31.56 5.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.772 0.32 . . . . 0.0 110.816 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.47 153.21 32.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.964 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -133.16 98.39 15.65 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.071 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.82 152.05 18.34 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.55 2.166 . . . . 0.0 112.271 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.74 100.31 6.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.869 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.468 HG22 ' HA ' ' A' ' 33' ' ' SER . 20.7 p -100.65 167.8 10.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.986 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.81 132.05 2.2 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.371 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -59.91 123.46 17.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.864 0.364 . . . . 0.0 110.87 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.607 HD21 ' CD1' ' A' ' 144' ' ' LEU . 0.1 OUTLIER -136.17 170.13 16.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.801 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.571 ' O ' HD23 ' A' ' 157' ' ' LEU . 8.1 mt-10 -104.29 152.45 22.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.061 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.519 ' HB2' HG21 ' A' ' 30' ' ' VAL . 26.6 tp -138.71 137.15 36.52 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.564 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.479 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 7.1 ptt180 -69.69 -165.34 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.763 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.0 t -171.42 135.31 0.92 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.977 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 168.0 49.56 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.488 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -107.45 178.39 4.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.899 0.38 . . . . 0.0 111.033 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.8 -78.74 0.61 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.547 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.6 p -162.28 157.64 23.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.849 0.357 . . . . 0.0 110.893 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 127.65 161.74 10.88 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.414 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -149.06 127.78 12.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.852 0.358 . . . . 0.0 111.058 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.92 39.66 85.08 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.628 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -141.89 56.62 0.58 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.401 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.99 125.2 25.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.877 0.37 . . . . 0.0 110.909 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.407 ' NH2' HD22 ' A' ' 75' ' ' LEU . 0.8 OUTLIER -116.27 74.27 0.89 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.775 -179.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.479 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 18.9 m95 -57.46 101.91 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.026 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -96.06 165.63 12.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.887 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.7 ttp180 -84.68 147.13 27.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.008 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.519 HG21 ' HB2' ' A' ' 14' ' ' LEU . 35.5 m -155.1 144.2 12.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.983 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.9 tp -100.48 124.68 46.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.573 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.542 HD22 HD13 ' A' ' 12' ' ' LEU . 3.5 mp -89.52 151.27 22.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.915 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.468 ' HA ' HG22 ' A' ' 9' ' ' THR . 10.3 t -131.39 98.42 4.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.596 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.735 ' HA ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -86.89 95.73 9.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.025 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -99.37 142.69 30.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.931 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -59.97 -17.62 39.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.352 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -93.48 -27.87 16.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.974 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.486 ' HB1' ' O ' ' A' ' 123' ' ' VAL . . . -179.94 -170.84 0.16 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.207 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 34' ' ' LEU . 8.2 tp -115.47 154.79 28.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.823 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.615 HG23 ' CD2' ' A' ' 122' ' ' HIS . 91.3 m -155.15 140.9 18.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.07 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.422 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 3.9 t -127.61 156.18 39.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.14 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -153.52 167.43 13.59 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.495 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -79.19 45.54 1.96 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.534 2.156 . . . . 0.0 112.749 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 47.13 29.51 1.15 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.01 0.433 . . . . 0.0 111.159 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.2 p30 -85.72 -176.85 6.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.88 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 167.62 -165.51 38.72 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.597 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -140.0 156.04 70.6 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 120.664 0.268 . . . . 0.0 110.874 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -68.22 151.69 76.58 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.489 2.126 . . . . 0.0 112.256 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -86.63 -80.05 1.19 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.603 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.502 ' HB2' ' HD2' ' A' ' 52' ' ' PRO . 93.0 Cg_endo -77.35 -164.28 0.26 Allowed 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.586 2.191 . . . . 0.0 112.2 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.44 ' HB2' ' HD3' ' A' ' 52' ' ' PRO . 1.0 OUTLIER -72.54 -48.86 9.03 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.571 -179.48 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.502 ' HD2' ' HB2' ' A' ' 50' ' ' PRO . 37.1 Cg_exo -60.9 101.49 0.18 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.422 2.082 . . . . 0.0 112.152 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -85.09 140.71 37.04 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.862 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.74 62.53 6.47 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.675 2.25 . . . . 0.0 112.348 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -149.93 157.45 43.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.161 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.39 -21.85 25.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.045 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 70.33 -65.85 0.3 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.782 0.325 . . . . 0.0 110.834 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -133.97 134.12 42.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.892 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -151.55 -86.56 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.509 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.93 174.64 15.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.743 0.306 . . . . 0.0 111.182 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -163.08 106.95 1.05 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.077 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.44 ' N ' ' HD2' ' A' ' 63' ' ' PRO . 0.6 OUTLIER -64.37 -58.95 12.02 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.019 179.924 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.44 ' HD2' ' N ' ' A' ' 62' ' ' GLU . 65.7 Cg_endo -75.42 169.36 22.59 Favored 'Trans proline' 0 N--CA 1.463 -0.279 0 C-N-CA 122.971 2.447 . . . . 0.0 112.297 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -139.28 -44.51 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.622 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -137.71 125.98 23.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.92 0.39 . . . . 0.0 111.135 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.22 154.85 42.66 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.104 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -69.07 110.37 2.4 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.585 2.19 . . . . 0.0 112.325 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -62.97 103.4 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.537 2.158 . . . . 0.0 112.268 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -146.3 21.57 1.36 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.099 0.475 . . . . 0.0 111.287 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.0 mp 62.14 145.78 0.08 OUTLIER Pre-proline 0 C--N 1.32 -0.714 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.903 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -56.22 -167.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.5 2.133 . . . . 0.0 112.185 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.642 ' HA ' HD11 ' A' ' 75' ' ' LEU . 2.4 mt-10 64.76 71.35 0.46 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.44 0.638 . . . . 0.0 110.81 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 168.61 -35.44 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.621 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 7.4 tt -110.08 -34.9 6.27 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.798 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.681 HD12 ' N ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -69.3 -15.06 63.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.451 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.681 ' N ' HD12 ' A' ' 75' ' ' LEU . 0.1 OUTLIER -88.47 -29.59 20.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.896 0.379 . . . . 0.0 111.008 -179.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -59.23 -26.3 64.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.083 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -94.28 42.39 1.09 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.871 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -150.48 30.67 0.67 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.857 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 23.7 t -124.28 -40.38 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.06 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.499 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.8 OUTLIER -54.69 -48.93 94.05 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.915 0.388 . . . . 0.0 111.279 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.499 ' CD ' ' N ' ' A' ' 81' ' ' SER . 2.9 Cg_exo -74.3 52.39 2.75 Favored 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 123.293 2.662 . . . . 0.0 112.34 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.415 ' CG ' ' O ' ' A' ' 82' ' ' PRO . 0.4 OUTLIER 174.61 38.67 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.899 0.381 . . . . 0.0 110.698 180.0 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.1 t80 179.64 127.27 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.734 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.4 mttt 60.77 172.74 0.1 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.898 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.5 p-10 -94.26 103.7 15.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.895 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.3 m -73.41 -168.41 0.53 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.887 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -144.82 92.87 2.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.036 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -171.78 143.83 7.75 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.529 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 89.63 -162.5 30.43 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.463 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.9 t -82.38 118.46 23.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.759 0.314 . . . . 0.0 110.834 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 18.3 m -138.63 111.46 7.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.928 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.1 p -91.6 150.49 3.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.048 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -178.1 -56.63 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.503 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 6.1 t-105 -125.83 38.89 4.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.816 0.341 . . . . 0.0 110.883 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 14.2 t70 60.88 31.98 20.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.925 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -83.27 155.51 66.64 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.856 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.91 111.07 2.74 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.634 2.223 . . . . 0.0 112.306 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -77.61 -27.7 5.98 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.504 2.136 . . . . 0.0 112.286 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -140.5 164.39 30.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.13 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 2.8 m -125.89 157.17 70.03 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.823 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -52.04 149.86 20.09 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.542 2.162 . . . . 0.0 112.222 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.6 mm? 60.89 109.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.861 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -82.53 147.75 28.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.928 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 22.8 mtp85 -80.88 139.02 36.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.859 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -172.71 59.08 0.24 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.834 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -69.21 -46.73 1.32 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.643 2.229 . . . . 0.0 112.311 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.8 t -92.32 167.66 11.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.917 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.1 m -90.25 138.51 27.19 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.869 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.95 162.04 32.45 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.523 2.148 . . . . 0.0 112.496 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.42 ' N ' ' HD3' ' A' ' 112' ' ' PRO . . . 57.12 62.97 5.75 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.919 -0.657 . . . . 0.0 112.707 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.42 ' HD3' ' N ' ' A' ' 111' ' ' GLY . 17.0 Cg_exo -66.93 -162.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.669 2.246 . . . . 0.0 112.259 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -138.9 101.15 7.87 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.842 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.67 122.51 9.92 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.43 2.086 . . . . 0.0 112.222 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.8 93.13 7.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.887 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -152.96 -46.54 0.1 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.88 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 7.3 tp -111.43 96.86 6.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.954 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.1 p -81.59 -31.74 32.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.878 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.83 -168.27 1.58 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.832 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.422 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -132.5 165.83 23.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.17 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.4 ' HB2' ' HB ' ' A' ' 41' ' ' VAL . 12.3 mtmm -104.48 90.48 3.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.96 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.615 ' CD2' HG23 ' A' ' 40' ' ' THR . 12.6 m-70 -93.03 116.3 28.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.935 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.636 HG13 ' HB2' ' A' ' 148' ' ' ALA . 4.5 t -90.93 115.97 31.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.893 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 21.2 m -57.05 -28.01 62.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.259 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.3 mp 63.97 -166.94 0.22 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.809 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.1 tttt 63.14 33.44 14.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.815 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.511 ' HG3' ' HB3' ' A' ' 149' ' ' ALA . 2.3 ptt? 176.76 -35.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.79 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.407 ' HB2' ' HA ' ' A' ' 148' ' ' ALA . . . -53.6 -175.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.376 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.476 ' CE2' ' CB ' ' A' ' 147' ' ' CYS . 1.0 OUTLIER -162.07 113.96 1.69 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.75 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.611 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.3 p -89.31 159.9 2.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.381 0.61 . . . . 0.0 111.414 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.488 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.4 OUTLIER -165.98 138.28 3.97 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.866 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.02 117.23 29.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.946 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.444 ' CB ' ' CZ ' ' A' ' 143' ' ' TYR . 0.0 OUTLIER -124.08 156.3 36.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.839 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 13.5 t -69.72 143.13 53.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.946 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.528 HG22 ' HD2' ' A' ' 136' ' ' PRO . 0.2 OUTLIER -105.54 142.34 24.54 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.858 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . 0.528 ' HD2' HG22 ' A' ' 135' ' ' THR . 45.7 Cg_exo -56.23 -26.38 60.83 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.524 2.15 . . . . 0.0 112.435 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 69.6 p -89.08 -37.27 15.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.111 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -107.35 119.49 50.64 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.075 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -69.56 -50.74 0.46 Allowed 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.361 2.041 . . . . 0.0 112.323 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.424 ' N ' ' CD ' ' A' ' 141' ' ' PRO . 2.9 mt-10 -93.49 -50.0 0.27 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.196 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 140' ' ' GLU . 34.8 Cg_exo -59.9 90.74 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.341 2.028 . . . . 0.0 112.223 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -76.16 128.65 35.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.838 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.444 ' CZ ' ' CB ' ' A' ' 133' ' ' ARG . 24.5 p90 -61.71 137.06 58.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.891 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.937 HD23 ' HB2' ' A' ' 169' ' ' ALA . 2.7 mt -92.17 105.57 17.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.441 ' HG3' ' CZ ' ' A' ' 156' ' ' PHE . 0.5 OUTLIER -100.29 115.31 29.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.938 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.978 HD13 HG21 ' A' ' 172' ' ' ILE . 28.1 mt -121.1 131.95 71.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.021 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.476 ' CB ' ' CE2' ' A' ' 129' ' ' TYR . 0.8 OUTLIER -120.47 123.41 42.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.972 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.636 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -106.22 147.34 29.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.083 0.468 . . . . 0.0 111.175 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.511 ' HB3' ' HG3' ' A' ' 127' ' ' MET . . . -95.47 30.38 2.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.303 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -112.68 43.65 1.62 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.072 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 122.39 23.84 2.29 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.106 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.417 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 5.9 mm-40 56.71 59.42 3.55 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 120.943 0.401 . . . . 0.0 110.957 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.432 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 3.0 m-20 -89.03 149.59 23.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.855 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.22 89.1 1.41 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.996 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 4.7 m -87.12 122.35 38.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.315 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.441 ' CZ ' ' HG3' ' A' ' 145' ' ' GLU . 7.9 m-85 -107.16 97.99 7.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.604 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.571 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.4 mt -104.39 162.0 13.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.183 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.456 ' HD2' HG21 ' A' ' 135' ' ' THR . 0.0 OUTLIER -132.97 87.63 2.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.636 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 1.094 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -49.97 172.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.515 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.2 tttm -78.56 -67.13 0.77 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.984 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -98.07 179.27 4.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.927 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.88 -40.87 21.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.887 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.97 94.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.071 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 1.4 m -66.09 -48.04 72.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.575 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 1.094 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -64.54 -34.98 79.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.775 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.11 -45.52 56.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.305 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 53.8 p -63.63 -36.94 85.47 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.594 ' CZ3' HD12 ' A' ' 34' ' ' LEU . 10.2 m95 -69.23 -57.08 5.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.463 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.937 ' HB2' HD23 ' A' ' 144' ' ' LEU . . . -49.5 -57.81 6.35 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.321 0.581 . . . . 0.0 110.715 179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.42 -38.11 56.99 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.564 -0.743 . . . . 0.0 112.619 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.63 -40.59 76.46 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 120.675 -0.41 . . . . 0.0 111.04 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.978 HG21 HD13 ' A' ' 146' ' ' ILE . 39.0 mm -60.94 -23.88 31.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 177.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.611 ' N ' HG11 ' A' ' 130' ' ' VAL . 2.2 tt0 -78.01 -37.53 46.89 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.494 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . 0.414 ' HA ' ' CG2' ' A' ' 178' ' ' THR . . . -60.38 -46.83 88.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.614 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 89.2 mm-40 -72.02 -34.2 68.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.188 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.614 ' CD1' HG22 ' A' ' 172' ' ' ILE . 41.9 mt -70.63 -29.24 37.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.688 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.418 ' O ' HG22 ' A' ' 178' ' ' THR . . . 145.63 -43.2 0.93 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.761 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . 0.418 HG22 ' O ' ' A' ' 177' ' ' GLY . 11.9 t . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.236 -0.887 . . . . 0.0 111.522 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.79 0.329 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -165.06 -60.36 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.985 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 121.94 -58.15 0.6 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.53 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -156.96 148.02 21.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.829 0.347 . . . . 0.0 110.962 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -176.05 142.71 0.52 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.885 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -118.01 116.96 35.7 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.096 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.85 154.13 67.75 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.417 2.078 . . . . 0.0 112.367 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -80.28 150.93 29.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.832 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 28.0 p -152.61 162.86 40.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.915 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 172.68 133.61 1.68 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.431 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.54 HD22 ' CD ' ' A' ' 29' ' ' ARG . 17.4 mt -63.09 120.1 10.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.783 0.325 . . . . 0.0 110.991 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.967 HD13 HD22 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -127.68 170.12 13.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.706 ' O ' HD23 ' A' ' 157' ' ' LEU . 3.0 tt0 -103.36 166.55 10.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.976 0.417 . . . . 0.0 111.122 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 26.1 tp -148.45 126.71 12.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.523 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.67 ' NH2' ' HB2' ' A' ' 18' ' ' ALA . 4.4 ptt180 -69.42 -166.8 0.11 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.909 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.6 t -170.89 70.63 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.83 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 158.39 133.08 1.49 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.524 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.67 ' HB2' ' NH2' ' A' ' 15' ' ' ARG . . . -150.69 128.63 11.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.807 0.337 . . . . 0.0 111.098 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -172.36 -84.85 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.413 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.45 33.12 4.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.734 0.302 . . . . 0.0 110.882 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.5 -122.28 6.04 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.513 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -78.26 139.59 38.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.722 0.296 . . . . 0.0 111.097 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 143.83 60.17 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.493 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.68 87.14 1.86 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.518 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -123.86 120.34 32.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.822 0.344 . . . . 0.0 110.837 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -108.36 68.27 0.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.839 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.482 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 31.0 m95 -58.92 164.24 3.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.967 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -153.86 173.62 15.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.937 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.54 ' CD ' HD22 ' A' ' 11' ' ' LEU . 0.8 OUTLIER -102.17 121.09 41.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.098 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.806 HG12 ' HA ' ' A' ' 43' ' ' PRO . 26.9 m -139.75 121.96 16.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.067 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.01 136.17 50.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.632 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.967 HD22 HD13 ' A' ' 12' ' ' LEU . 1.8 mp -102.57 159.76 15.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 t -142.11 92.06 2.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.679 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -79.39 97.38 6.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.858 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -101.01 137.49 39.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.062 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -56.82 -23.09 41.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.115 0.483 . . . . 0.0 111.229 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.523 ' OD1' ' HB1' ' A' ' 35' ' ' ALA . 6.7 p-10 -86.6 -32.28 20.71 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.778 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.63 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -178.15 175.27 1.25 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.175 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.885 ' HB2' HD13 ' A' ' 125' ' ' LEU . 0.3 OUTLIER -103.18 131.36 50.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.623 179.817 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.693 ' N ' HD13 ' A' ' 39' ' ' LEU . 70.4 m -131.1 128.41 40.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.942 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.569 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 15.9 t -114.93 159.13 14.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.136 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.469 ' N ' HG12 ' A' ' 41' ' ' VAL . 2.6 t -155.64 153.16 25.78 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.552 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.806 ' HA ' HG12 ' A' ' 30' ' ' VAL . 72.3 Cg_endo -74.33 45.13 1.15 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.548 2.165 . . . . 0.0 112.822 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 46.44 29.87 0.97 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.916 0.388 . . . . 0.0 111.345 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -58.74 128.09 35.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.895 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 174.02 -165.17 36.76 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.588 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -143.59 80.31 13.04 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.683 0.278 . . . . 0.0 110.878 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.18 142.07 45.14 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.58 2.187 . . . . 0.0 112.296 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 163.73 94.07 0.1 OUTLIER Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.427 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -51.2 -47.94 23.47 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.583 2.188 . . . . 0.0 112.394 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -126.1 148.68 64.08 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.807 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.55 124.06 14.31 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.557 2.171 . . . . 0.0 112.212 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -146.93 77.07 11.23 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.878 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.76 174.74 0.1 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.582 2.188 . . . . 0.0 112.235 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.92 135.0 51.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.071 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.28 98.37 7.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.857 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.578 HD23 ' H ' ' A' ' 57' ' ' LEU . 0.5 OUTLIER -69.79 160.52 31.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 60.52 160.14 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.907 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 127.78 -69.26 0.53 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.486 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -119.33 96.05 5.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.887 0.375 . . . . 0.0 111.06 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 60.01 172.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.062 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -86.66 127.27 61.03 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.874 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.16 165.24 33.2 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.397 2.064 . . . . 0.0 112.299 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -151.01 -108.77 0.42 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.395 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -118.36 179.2 4.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.912 0.387 . . . . 0.0 111.082 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -126.41 97.68 33.62 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.045 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -67.62 139.47 48.72 Favored 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 122.382 2.055 . . . . 0.0 112.21 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.09 60.49 5.52 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.478 2.118 . . . . 0.0 112.375 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -87.68 138.75 31.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.868 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.4 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 45.5 mt -92.11 132.86 31.39 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.794 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 70' ' ' LEU . 50.3 Cg_exo -55.03 -173.76 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.319 2.013 . . . . 0.0 112.224 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.681 ' HA ' HD11 ' A' ' 75' ' ' LEU . 2.4 mt-10 64.51 71.0 0.48 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.387 0.613 . . . . 0.0 110.724 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.551 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 167.22 -35.94 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.387 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.1 tt -106.75 -27.92 10.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.776 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.701 HD12 ' N ' ' A' ' 76' ' ' LEU . 0.4 OUTLIER -83.4 -13.85 53.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.366 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.701 ' N ' HD12 ' A' ' 75' ' ' LEU . 5.0 mt -95.49 27.3 3.45 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.828 0.347 . . . . 0.0 111.133 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -153.84 26.21 0.49 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.888 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.4 ptm85 -131.24 -39.53 1.17 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.091 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.414 ' HG3' ' CE1' ' A' ' 84' ' ' PHE . 22.0 pt-20 -95.43 30.83 2.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.052 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.7 t -117.43 -30.11 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.201 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.484 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -55.04 -49.13 93.96 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.29 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.484 ' CD ' ' N ' ' A' ' 81' ' ' SER . 53.8 Cg_endo -92.4 -141.11 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 123.597 2.864 . . . . 0.0 111.649 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.414 ' H ' ' HB2' ' A' ' 82' ' ' PRO . 61.0 m-85 -90.72 148.62 22.47 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.003 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.414 ' CE1' ' HG3' ' A' ' 79' ' ' GLU . 0.1 OUTLIER -95.94 86.06 4.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.805 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.17 54.36 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.863 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -176.25 117.4 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.921 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -119.56 31.57 6.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.953 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 59.84 108.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.159 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -97.42 29.02 11.59 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.404 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 93.71 46.52 3.16 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.816 -0.706 . . . . 0.0 112.498 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 3.6 t -148.51 156.51 42.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.855 0.36 . . . . 0.0 110.873 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 6.0 t -110.01 144.13 39.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.817 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 9.8 p -62.44 147.2 11.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.058 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 147.48 -45.14 0.77 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.457 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 60.37 96.79 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.771 0.32 . . . . 0.0 110.846 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -164.47 68.52 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.804 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.76 112.54 4.58 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.895 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo -51.05 161.56 1.47 Allowed 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.457 2.105 . . . . 0.0 112.334 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -73.85 -27.8 12.0 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.653 2.235 . . . . 0.0 112.316 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -128.16 100.73 5.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.054 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.82 100.89 0.27 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.922 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -68.61 64.54 1.21 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.358 2.038 . . . . 0.0 112.319 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 12.6 mt -105.88 141.18 37.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.895 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -127.39 111.15 13.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.947 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.82 160.55 38.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.8 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -89.59 140.36 28.18 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.848 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -75.27 -44.87 0.29 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.462 2.108 . . . . 0.0 112.393 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 30.9 t -83.11 132.09 35.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.45 ' N ' ' CD ' ' A' ' 110' ' ' PRO . 0.5 OUTLIER -83.22 -52.19 0.63 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.064 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.45 ' CD ' ' N ' ' A' ' 109' ' ' SER . 41.1 Cg_exo -55.61 162.42 6.46 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.813 2.342 . . . . 0.0 112.218 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.461 ' N ' ' HD3' ' A' ' 112' ' ' PRO . . . -149.95 60.96 0.42 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.635 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.461 ' HD3' ' N ' ' A' ' 111' ' ' GLY . 12.4 Cg_exo -69.89 -164.83 0.14 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.679 2.252 . . . . 0.0 112.086 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 18.0 mp0 -116.76 143.81 32.14 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.768 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_exo -51.71 126.8 20.75 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.517 2.145 . . . . 0.0 112.345 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.8 mtp-105 -148.13 105.86 3.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.889 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -166.88 -51.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.89 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.626 HD23 ' HD3' ' A' ' 43' ' ' PRO . 23.1 tp -84.27 -64.12 1.22 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.84 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 58.04 30.09 18.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.962 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -165.43 119.89 1.26 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.833 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.569 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -83.0 166.86 18.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.136 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 17.7 mttm -117.76 103.77 10.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.92 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 8.1 m170 -101.56 101.99 12.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.042 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.433 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 2.9 t -90.03 139.43 17.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.868 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.2 p -54.83 -36.98 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.22 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.885 HD13 ' HB2' ' A' ' 39' ' ' LEU . 6.4 tp 62.71 30.71 16.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.003 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.542 ' HG3' HG21 ' A' ' 178' ' ' THR . 1.9 tptt -143.85 36.66 1.29 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.41 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.406 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER 177.27 -30.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.8 -179.832 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.438 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -55.3 -166.64 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.23 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.483 ' HA ' HG21 ' A' ' 176' ' ' ILE . 14.7 t80 -165.89 122.39 1.36 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.656 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.559 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.8 p -99.28 159.97 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.399 0.619 . . . . 0.0 111.657 -179.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.498 ' N ' HG22 ' A' ' 130' ' ' VAL . 4.5 p -160.81 154.58 22.42 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.562 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.66 100.14 5.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.905 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.08 172.85 7.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.849 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 26.3 p -79.29 179.96 7.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.973 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.645 HG21 ' CE1' ' A' ' 143' ' ' TYR . 1.7 m -143.01 101.4 5.31 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -49.69 -26.87 13.88 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.502 2.135 . . . . 0.0 112.471 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . 0.484 ' OG1' HG22 ' A' ' 135' ' ' THR . 2.6 p -80.44 -31.53 37.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.901 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -151.25 91.79 3.86 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.842 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.26 83.14 2.2 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.459 2.106 . . . . 0.0 112.359 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.431 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.1 OUTLIER -177.2 -62.71 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.962 179.828 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.431 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 41.0 Cg_endo -67.07 -21.62 48.86 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.493 2.129 . . . . 0.0 112.401 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 61.09 156.18 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.983 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.645 ' CE1' HG21 ' A' ' 135' ' ' THR . 1.4 m-30 -106.18 112.48 25.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.922 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.691 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 0.4 OUTLIER -81.21 153.21 27.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.834 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.414 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.1 tt0 -158.77 137.78 11.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.511 HG12 HG21 ' A' ' 172' ' ' ILE . 4.5 mp -141.65 120.82 10.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.053 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.438 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 16.3 m -100.95 139.58 36.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.851 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -106.7 149.08 27.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.425 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.406 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.73 30.3 2.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.215 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -121.73 48.49 1.69 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.071 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.58 18.81 3.93 Favored Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.123 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.432 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 3.3 mm-40 58.97 61.48 2.13 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.086 0.47 . . . . 0.0 111.005 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.5 165.54 15.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.552 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.96 96.56 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.219 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.8 m -91.85 127.09 44.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.266 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.414 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 0.2 OUTLIER -107.48 117.35 33.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.668 179.787 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.706 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.0 OUTLIER -124.72 161.3 26.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.029 -179.813 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.456 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -127.31 112.77 15.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.842 -179.903 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.959 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -71.05 172.92 8.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.094 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -80.77 -66.47 0.88 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.929 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -103.0 -178.36 3.64 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.886 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -75.84 -49.45 17.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.964 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -60.37 -36.69 78.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.151 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 66.3 m -67.62 -44.21 78.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.761 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.959 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -66.96 -37.9 85.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.809 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -73.68 -41.74 62.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.316 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 3.7 m -65.77 -32.73 74.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.924 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.497 ' CZ3' HD12 ' A' ' 34' ' ' LEU . 11.3 m95 -75.76 -54.88 6.25 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.57 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.691 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -57.44 -47.29 82.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.323 0.583 . . . . 0.0 110.407 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -60.46 -41.72 98.73 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.638 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.7 -40.19 73.0 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.855 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.693 HG22 HD12 ' A' ' 176' ' ' ILE . 17.3 mt -60.88 -24.39 32.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.559 ' N ' HG11 ' A' ' 130' ' ' VAL . 17.8 tt0 -80.61 -31.67 36.56 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.229 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -62.36 -48.83 78.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.241 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -67.89 -40.77 83.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.773 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.693 HD12 HG22 ' A' ' 172' ' ' ILE . 81.9 mt -77.6 -4.77 6.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.414 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -83.51 20.18 12.17 Favored Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.896 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . 0.542 HG21 ' HG3' ' A' ' 126' ' ' LYS . 1.4 t . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.805 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.907 0.384 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.2 p -96.24 153.92 17.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.857 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 80.26 97.91 0.33 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.492 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -108.09 30.25 6.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.854 0.359 . . . . 0.0 110.973 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 58.81 78.25 0.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.926 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -147.9 96.96 3.97 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.99 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.421 ' HB3' ' HB2' ' A' ' 35' ' ' ALA . 36.9 Cg_exo -59.82 150.83 75.2 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.548 2.165 . . . . 0.0 112.237 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.6 ttt85 -93.49 129.62 39.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.488 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.624 HG22 ' HA ' ' A' ' 33' ' ' SER . 10.6 p -137.59 140.77 41.17 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.929 0.395 . . . . 0.0 111.198 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.18 135.1 6.25 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.367 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 11' ' ' LEU . 11.3 mt -58.64 108.17 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.936 0.398 . . . . 0.0 111.006 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 157' ' ' LEU . 0.0 OUTLIER -118.87 164.79 14.91 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.755 179.859 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -102.96 155.54 18.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.946 0.403 . . . . 0.0 111.019 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 156' ' ' PHE . 5.8 tp -133.96 135.17 43.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.614 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.477 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 31.0 ttp180 -69.59 166.84 18.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.803 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.0 t -142.95 163.76 31.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.789 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -163.82 -53.94 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.534 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -84.27 170.66 13.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.811 0.339 . . . . 0.0 111.088 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.58 -97.07 2.11 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.418 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.6 m -135.29 -177.13 4.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.819 0.342 . . . . 0.0 110.958 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.75 -159.09 14.15 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.461 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -171.11 171.03 5.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.825 0.345 . . . . 0.0 111.071 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.68 -69.71 3.25 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.466 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -169.6 -98.65 0.12 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.517 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -97.63 154.09 17.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.779 0.323 . . . . 0.0 111.042 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.1 ttt180 -137.27 71.37 1.4 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.838 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.477 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 45.1 m95 -48.2 166.2 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.168 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -154.59 -172.42 4.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.945 0.403 . . . . 0.0 111.058 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -109.7 121.84 46.13 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.048 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.686 HG12 ' HA ' ' A' ' 43' ' ' PRO . 30.6 m -140.51 124.28 17.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.094 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tp -69.72 120.86 16.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.567 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.691 HD12 HG13 ' A' ' 41' ' ' VAL . 7.5 tp -89.08 116.35 27.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.017 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.624 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.2 OUTLIER -96.58 89.36 4.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.676 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.707 HD12 ' HG ' ' A' ' 39' ' ' LEU . 1.2 tp -89.15 123.99 33.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.003 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.421 ' HB2' ' HB3' ' A' ' 7' ' ' PRO . . . -134.5 149.21 50.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.027 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.4 -16.87 50.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.46 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -92.32 -27.02 17.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.013 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.424 ' HA ' HD13 ' A' ' 125' ' ' LEU . . . -178.58 176.75 0.97 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.047 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.707 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -124.33 95.6 4.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.844 179.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 60.5 m -102.69 130.24 49.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.984 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.691 HG13 HD12 ' A' ' 32' ' ' LEU . 9.8 t -100.72 157.64 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.06 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.429 ' N ' HG12 ' A' ' 41' ' ' VAL . 15.8 p -147.33 154.15 45.23 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.603 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.686 ' HA ' HG12 ' A' ' 30' ' ' VAL . 71.9 Cg_endo -77.43 40.51 0.85 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.592 2.195 . . . . 0.0 112.779 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 54.79 27.01 8.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.191 0.52 . . . . 0.0 111.015 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.84 152.91 40.12 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.878 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.58 120.33 2.66 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.577 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.528 ' N ' ' CD ' ' A' ' 48' ' ' PRO . 1.3 mt-10 -81.74 -46.32 1.05 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 120.666 0.269 . . . . 0.0 111.357 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 47' ' ' GLU . 63.8 Cg_exo -50.93 144.43 27.52 Favored 'Trans proline' 0 C--O 1.233 0.237 0 C-N-CA 122.741 2.294 . . . . 0.0 112.388 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 70.12 150.94 0.58 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.499 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -68.44 179.82 2.78 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.536 2.157 . . . . 0.0 112.284 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -140.57 157.46 68.04 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.847 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.04 160.58 43.81 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.597 2.198 . . . . 0.0 112.224 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -56.88 108.98 1.4 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.998 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.87 -174.49 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.46 2.106 . . . . 0.0 112.35 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 62.92 144.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.193 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.538 ' C ' HD13 ' A' ' 57' ' ' LEU . 0.1 OUTLIER 60.01 -178.45 0.1 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.936 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.695 HD13 ' N ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -149.95 170.92 17.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.016 179.875 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -59.47 173.67 0.5 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.162 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -159.39 61.16 0.31 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.488 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.45 158.82 28.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.799 0.333 . . . . 0.0 111.138 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -117.82 49.2 1.26 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.019 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -135.55 114.31 11.26 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -51.75 -178.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.382 2.055 . . . . 0.0 112.329 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 173.09 -153.36 18.06 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.424 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -78.95 94.54 5.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.822 0.344 . . . . 0.0 111.164 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -127.5 88.36 53.92 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.033 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 161.01 47.59 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.535 2.157 . . . . 0.0 112.335 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.3 134.68 57.86 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.636 2.224 . . . . 0.0 112.312 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 62.51 144.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.972 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.431 ' N ' ' HD2' ' A' ' 71' ' ' PRO . 0.2 OUTLIER -72.77 -58.95 2.52 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.111 179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.431 ' HD2' ' N ' ' A' ' 70' ' ' LEU . 69.8 Cg_endo -75.55 143.66 27.62 Favored 'Trans proline' 0 N--CA 1.465 -0.182 0 C-N-CA 122.876 2.384 . . . . 0.0 112.379 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.571 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.1 mt-10 60.57 68.21 0.77 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.394 0.616 . . . . 0.0 110.696 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.571 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 163.62 -39.06 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.606 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 9.2 tt -90.32 -32.09 16.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.879 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.525 ' H ' HD12 ' A' ' 75' ' ' LEU . 5.5 mp -67.81 -41.78 82.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.926 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.5 tp -59.51 -56.08 26.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.98 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.9 48.21 1.33 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.977 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -84.25 -10.22 57.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.421 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -94.27 41.26 1.09 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.842 0.353 . . . . 0.0 111.015 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 23.7 t -143.04 -64.25 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 59.04 168.3 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -68.4 60.05 1.06 Allowed 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.863 2.375 . . . . 0.0 112.277 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -162.75 32.01 0.1 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.872 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -156.42 113.47 3.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.835 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -101.33 159.95 14.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.844 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -95.65 -31.9 13.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.901 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.6 m -66.31 -45.05 81.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -96.71 38.29 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.193 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.45 122.94 19.1 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.524 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -153.72 -137.06 2.4 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.478 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.0 t -145.25 146.93 31.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.73 0.3 . . . . 0.0 110.909 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.6 m -130.02 133.0 46.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.886 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.508 ' O ' HG13 ' A' ' 93' ' ' VAL . 12.1 p -61.89 118.66 4.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.052 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -166.73 84.55 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.525 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -131.95 39.13 3.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.871 0.367 . . . . 0.0 110.859 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -151.82 62.42 0.86 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.804 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 15.7 m -145.74 158.19 50.07 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.886 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -67.28 162.81 36.97 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.492 2.128 . . . . 0.0 112.321 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.45 -21.04 35.5 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.538 2.159 . . . . 0.0 112.442 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -104.98 160.38 15.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.192 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.9 156.14 65.61 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.761 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -69.02 171.19 14.08 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.535 2.157 . . . . 0.0 112.326 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 mp -61.44 121.86 13.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.927 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -110.05 -30.11 7.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.012 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -74.45 -75.47 0.16 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.927 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -177.91 148.39 0.66 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.968 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.73 -25.9 19.95 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.591 2.194 . . . . 0.0 112.35 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m 63.59 161.6 0.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.947 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.3 m -90.41 111.82 49.42 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.906 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.33 125.37 11.77 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.429 2.086 . . . . 0.0 112.309 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -151.78 -96.46 0.14 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.469 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.72 134.84 60.4 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.458 2.105 . . . . 0.0 112.233 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -81.3 110.35 18.1 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.812 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.63 136.95 31.88 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.439 2.093 . . . . 0.0 112.348 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 50.9 mtt180 -87.01 56.14 3.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.849 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.481 ' ND2' HD23 ' A' ' 14' ' ' LEU . 0.8 OUTLIER -126.4 -63.1 1.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.908 179.949 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.504 HD13 HG11 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -147.81 106.93 3.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.027 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.1 m -123.21 -41.37 2.32 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.893 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.435 ' O ' ' HB3' ' A' ' 120' ' ' ALA . 0.2 OUTLIER -117.75 23.26 11.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.073 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.435 ' HB3' ' O ' ' A' ' 119' ' ' GLU . . . 69.42 157.75 0.16 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.036 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 12.6 mttm -106.81 81.08 1.52 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.008 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -72.24 93.63 1.49 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.873 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.49 HG13 ' HB2' ' A' ' 148' ' ' ALA . 21.5 t -88.2 111.21 22.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.207 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.29 129.06 38.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.844 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.522 HD23 ' O ' ' A' ' 175' ' ' GLN . 2.3 mp -88.9 -170.02 2.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.031 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.29 38.5 16.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.773 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.42 ' HG2' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -179.88 -38.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.858 179.956 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.73 -169.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.205 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -162.19 115.04 1.74 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.471 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.585 HG22 ' N ' ' A' ' 131' ' ' SER . 7.1 p -91.0 162.42 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.479 0.657 . . . . 0.0 111.793 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.585 ' N ' HG22 ' A' ' 130' ' ' VAL . 1.1 m -165.35 141.41 5.39 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.492 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.593 ' HD3' ' HB3' ' A' ' 169' ' ' ALA . 19.7 ptt85 -107.76 115.31 29.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.953 0.406 . . . . 0.0 111.043 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.466 ' O ' ' N ' ' A' ' 143' ' ' TYR . 2.8 mtp180 -118.64 -173.8 2.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.595 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . 0.462 ' C ' HG22 ' A' ' 135' ' ' THR . 0.8 OUTLIER -139.4 -178.85 5.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.995 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.636 HG23 ' HD3' ' A' ' 136' ' ' PRO . 0.2 OUTLIER -165.0 -58.35 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.341 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.43 179.944 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . 0.636 ' HD3' HG23 ' A' ' 135' ' ' THR . 88.6 Cg_exo -46.35 -66.79 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.425 2.084 . . . . 0.0 112.765 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.2 p -108.92 -9.06 15.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.804 0.335 . . . . 0.0 111.01 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.545 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 13.5 m-20 65.43 38.68 0.23 Allowed Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.139 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.545 ' CD ' ' N ' ' A' ' 138' ' ' ASP . 74.0 Cg_endo -76.97 -50.09 0.1 Allowed 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 121.903 1.735 . . . . 0.0 111.864 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.556 ' CB ' ' HD3' ' A' ' 141' ' ' PRO . 1.1 mt-10 163.76 -63.47 0.0 OUTLIER Pre-proline 0 CA--C 1.53 0.205 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.472 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.556 ' HD3' ' CB ' ' A' ' 140' ' ' GLU . 49.6 Cg_endo -90.38 85.59 0.39 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.824 2.349 . . . . 0.0 112.604 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -159.84 27.67 0.18 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.346 . . . . 0.0 111.473 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.466 ' N ' ' O ' ' A' ' 133' ' ' ARG . 19.3 t80 -177.5 83.2 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.946 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.11 108.77 12.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.712 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -111.88 144.13 41.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.501 HG12 HG23 ' A' ' 130' ' ' VAL . 19.6 mt -139.1 126.03 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.066 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 1.8 p -111.65 117.83 33.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.542 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -98.61 146.34 25.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.236 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.42 ' HB3' ' HG2' ' A' ' 127' ' ' MET . . . -96.05 31.68 2.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.237 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -115.33 44.62 1.8 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.33 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.56 24.21 2.42 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.484 -179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.33 60.09 2.76 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 120.985 0.421 . . . . 0.0 110.969 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.542 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 0.7 OUTLIER -91.7 151.98 20.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.739 179.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -155.05 90.0 1.25 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.247 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 10.4 m -89.21 127.58 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.075 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.518 ' O ' HD12 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -112.78 117.23 31.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.918 179.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.604 ' HB3' HD23 ' A' ' 12' ' ' LEU . 1.1 mp -126.62 168.69 13.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.437 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 1.7 ttp85 -142.32 118.2 10.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.954 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.847 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -78.05 172.67 13.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.037 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.99 -31.79 12.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -106.41 140.17 39.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.926 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -66.37 -42.85 87.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.085 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.88 -46.11 75.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.067 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.47 -49.53 77.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.62 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.847 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -58.25 -38.93 77.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.139 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . 0.405 ' HA ' ' HD3' ' A' ' 132' ' ' ARG . 1.6 ttt-85 -69.7 -47.79 61.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.532 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.64 -30.81 71.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.022 0.439 . . . . 0.0 110.249 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.676 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 6.0 m95 -72.13 -48.95 39.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.972 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.593 ' HB3' ' HD3' ' A' ' 132' ' ' ARG . . . -57.87 -54.55 45.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.283 0.564 . . . . 0.0 110.545 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.64 -36.96 80.98 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.642 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -72.84 -39.57 66.46 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 120.966 0.413 . . . . 0.0 110.615 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.511 HG12 HD13 ' A' ' 34' ' ' LEU . 11.9 mt -61.94 -22.74 29.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.5 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.7 OUTLIER -77.96 -44.77 25.79 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.532 179.644 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . 0.67 ' HA ' HG22 ' A' ' 178' ' ' THR . . . -64.82 -33.94 77.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.591 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . 0.522 ' O ' HD23 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -79.45 -29.84 41.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.981 179.174 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.455 ' CD1' HG22 ' A' ' 172' ' ' ILE . 6.1 mt -68.04 -28.93 42.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.53 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 112.73 34.72 1.82 Allowed Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.685 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . 0.67 HG22 ' HA ' ' A' ' 174' ' ' ALA . 1.1 t . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.957 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.846 0.355 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.2 m -98.72 124.38 43.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.848 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.59 169.79 17.53 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.472 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.1 ttt-85 -127.53 104.98 8.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.851 0.357 . . . . 0.0 110.775 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.25 143.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.844 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.79 140.47 37.79 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.145 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.06 165.79 25.19 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.606 2.204 . . . . 0.0 112.278 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.609 ' CD ' HD23 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -107.7 153.5 22.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.683 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.777 HG22 ' HA ' ' A' ' 33' ' ' SER . 28.6 p -140.35 161.37 37.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.06 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -161.31 126.49 1.59 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.414 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.683 HD13 ' HE ' ' A' ' 29' ' ' ARG . 67.9 mt -60.32 110.46 1.25 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.744 0.307 . . . . 0.0 110.936 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.435 HD13 HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -121.45 132.54 54.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.87 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.37 149.6 47.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.818 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 58.0 tp -125.51 139.69 53.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.772 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.461 ' HA ' ' CD2' ' A' ' 27' ' ' TRP . 6.1 ttm180 -69.41 -178.06 1.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.445 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -168.52 -42.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.881 0.372 . . . . 0.0 110.993 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -78.87 145.12 28.31 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.624 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -110.02 105.49 14.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.767 0.318 . . . . 0.0 110.944 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.79 170.67 31.25 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.592 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 97.0 p -133.73 99.72 4.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.938 0.399 . . . . 0.0 110.911 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.04 -79.89 0.28 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.483 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -153.28 146.07 24.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.835 0.35 . . . . 0.0 111.108 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.04 -30.93 0.21 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.52 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 136.28 77.04 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.531 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -79.83 134.4 36.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.77 0.319 . . . . 0.0 110.92 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 39.2 mtp85 -100.35 139.74 35.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.812 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.477 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 28.0 m95 -149.15 117.61 6.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.86 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -102.11 -173.35 2.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.972 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.683 ' HE ' HD13 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -112.15 128.03 56.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.897 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.707 HG12 ' HA ' ' A' ' 43' ' ' PRO . 25.5 m -143.62 122.95 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.172 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tp -69.82 137.01 51.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.576 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.547 HD12 HG13 ' A' ' 41' ' ' VAL . 1.8 mp -106.81 109.92 21.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.14 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.777 ' HA ' HG22 ' A' ' 9' ' ' THR . 1.2 m -85.14 88.17 7.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.604 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.968 HD12 HD13 ' A' ' 39' ' ' LEU . 3.0 tp -79.76 131.36 35.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.191 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.59 145.51 38.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.913 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.46 -15.15 48.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.447 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -96.29 -24.02 16.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.046 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.741 ' HB1' ' O ' ' A' ' 123' ' ' VAL . . . -177.42 -178.68 0.78 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 0.0 111.153 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.968 HD13 HD12 ' A' ' 34' ' ' LEU . 30.4 tp -128.32 102.88 6.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.722 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.635 HG23 ' CD2' ' A' ' 122' ' ' HIS . 58.5 m -102.91 136.39 42.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.031 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.547 HG13 HD12 ' A' ' 32' ' ' LEU . 16.7 t -109.25 159.33 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.101 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.478 ' N ' HG12 ' A' ' 41' ' ' VAL . 11.9 t -160.08 149.29 14.1 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.495 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.736 ' HD3' HD23 ' A' ' 117' ' ' LEU . 74.3 Cg_endo -75.17 46.92 1.66 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.622 2.215 . . . . 0.0 112.907 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 46.95 29.41 1.03 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.972 0.415 . . . . 0.0 111.244 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -171.44 104.4 0.21 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.025 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -97.3 113.47 4.72 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.348 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -135.77 96.93 12.95 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.639 0.257 . . . . 0.0 110.914 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.0 -167.46 0.17 Allowed 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.39 2.06 . . . . 0.0 112.129 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -152.82 72.18 0.27 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.602 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.06 94.58 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.538 2.159 . . . . 0.0 112.258 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 60.92 80.31 0.26 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.827 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -77.69 175.73 10.88 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.585 2.19 . . . . 0.0 112.485 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -90.54 157.01 44.96 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.781 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.01 101.38 0.8 Allowed 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.557 2.171 . . . . 0.0 112.281 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.13 107.18 2.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.04 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 61.22 -171.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.814 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.8 mp -90.85 -71.17 0.64 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.872 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 16.8 m120 58.87 90.52 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.961 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -123.73 42.24 1.61 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.483 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -170.57 158.95 6.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.811 0.339 . . . . 0.0 111.098 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 61.45 153.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.013 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -58.51 109.71 2.05 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.035 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.15 142.99 39.03 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.454 2.103 . . . . 0.0 112.321 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -159.35 -161.63 11.38 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.471 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -136.33 68.46 1.44 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.823 0.344 . . . . 0.0 111.046 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -89.64 144.45 31.91 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.012 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -73.83 110.85 3.16 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.548 2.165 . . . . 0.0 112.483 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -76.5 167.85 24.84 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.5 2.133 . . . . 0.0 112.278 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.867 ' O ' HD23 ' A' ' 70' ' ' LEU . 14.0 pt20 -78.92 152.38 31.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.955 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.867 HD23 ' O ' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -156.01 -63.54 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.075 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.465 ' HD2' ' H ' ' A' ' 70' ' ' LEU . 21.6 Cg_endo -61.95 -166.73 0.05 OUTLIER 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.693 2.262 . . . . 0.0 112.152 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.545 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 1.7 mt-10 65.85 71.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.36 0.6 . . . . 0.0 110.725 -179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 168.12 -41.03 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.891 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -112.58 -32.89 6.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.195 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.948 HD13 ' N ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -61.33 -16.98 51.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.401 -179.723 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.948 ' N ' HD13 ' A' ' 75' ' ' LEU . 0.1 OUTLIER -90.24 3.05 54.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.262 -179.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -140.94 38.57 1.79 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.829 0.347 . . . . 0.0 110.968 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -88.51 -57.11 3.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.986 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -92.65 47.12 1.27 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.916 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 4.8 t -128.85 -57.0 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.866 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.463 ' CB ' ' HD2' ' A' ' 82' ' ' PRO . 0.3 OUTLIER -96.22 174.1 3.67 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.615 179.914 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.463 ' HD2' ' CB ' ' A' ' 81' ' ' SER . 63.2 Cg_endo -74.22 59.72 4.63 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.38 2.054 . . . . 0.0 112.156 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.9 t80 71.9 77.81 0.16 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.825 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -76.02 122.91 24.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.909 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -151.83 159.18 43.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -56.87 156.48 6.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.997 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -99.61 160.87 13.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.958 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 59.86 82.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.095 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 173.3 133.61 1.7 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.508 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 109.34 -99.89 1.3 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.522 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.7 t -118.4 -40.86 2.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.715 0.293 . . . . 0.0 110.886 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 61.04 159.16 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.857 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.2 p -85.6 136.53 22.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.106 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 140.65 80.53 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.509 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 6.6 m0 -113.76 34.29 4.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.874 0.369 . . . . 0.0 110.915 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -110.71 40.71 1.94 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.939 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.1 t 62.83 89.3 0.11 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.928 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.46 128.63 16.59 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.653 2.235 . . . . 0.0 112.169 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.24 -27.97 86.43 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.362 2.041 . . . . 0.0 112.121 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.46 175.22 5.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.175 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.4 t -149.18 88.65 5.03 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.885 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -51.26 148.22 19.26 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.637 2.225 . . . . 0.0 112.395 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.423 ' C ' HD12 ' A' ' 103' ' ' LEU . 2.4 pp -166.81 33.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.87 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -72.58 124.49 25.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.28 135.27 45.23 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.832 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -103.44 92.21 3.84 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.816 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -68.18 66.73 1.01 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.418 2.079 . . . . 0.0 112.231 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.1 m -125.52 73.99 1.36 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.869 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.8 t 60.7 79.47 0.28 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.871 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.13 138.23 33.09 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.572 2.181 . . . . 0.0 112.232 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.13 -178.28 19.35 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.457 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -53.83 -171.54 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.649 2.232 . . . . 0.0 112.313 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -130.78 118.06 17.59 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.934 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.37 -170.81 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.354 2.036 . . . . 0.0 112.29 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 -141.53 -177.69 5.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.952 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.3 p-10 -59.54 -50.42 73.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.965 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.736 HD23 ' HD3' ' A' ' 43' ' ' PRO . 20.7 tp -90.75 -68.78 0.77 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.924 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 5.9 t 50.69 27.01 2.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.203 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -161.69 118.25 2.14 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.844 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.22 140.07 58.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.023 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -101.33 88.88 3.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.054 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.635 ' CD2' HG23 ' A' ' 40' ' ' THR . 11.1 m170 -76.69 109.01 10.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.932 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.741 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 21.5 t -109.89 150.84 12.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.102 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 87.1 p -87.48 157.24 19.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.906 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.4 ' HA ' HD12 ' A' ' 125' ' ' LEU . 1.5 tp -120.67 31.75 6.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.923 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -133.39 38.38 3.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.707 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.765 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 1.4 mtt 177.6 -34.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.874 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.459 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -55.0 -171.53 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.988 0.423 . . . . 0.0 111.31 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -168.44 116.56 0.7 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.434 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.557 HG11 ' N ' ' A' ' 173' ' ' GLN . 1.9 p -88.04 158.47 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.314 0.578 . . . . 0.0 111.579 -179.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.467 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 93.6 p -168.48 159.2 10.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.756 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 16.8 ptt85 -132.89 126.59 32.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.042 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -148.54 172.7 14.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.804 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -120.8 -176.46 3.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.944 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.574 HG23 ' HD3' ' A' ' 136' ' ' PRO . 0.4 OUTLIER -138.69 -62.46 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.257 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . 0.574 ' HD3' HG23 ' A' ' 135' ' ' THR . 81.7 Cg_endo -83.95 -8.24 10.1 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.176 1.917 . . . . 0.0 112.578 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . 0.509 HG23 ' C ' ' A' ' 136' ' ' PRO . 1.2 p 70.88 32.97 2.28 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.992 0.425 . . . . 0.0 110.732 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.502 ' H ' ' HD2' ' A' ' 139' ' ' PRO . 0.4 OUTLIER -111.57 -68.66 0.03 OUTLIER Pre-proline 0 CA--C 1.531 0.238 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.326 -179.832 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.502 ' HD2' ' H ' ' A' ' 138' ' ' ASP . 18.5 Cg_endo -58.95 98.71 0.1 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.191 1.927 . . . . 0.0 112.408 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.453 ' N ' ' CD ' ' A' ' 141' ' ' PRO . 0.2 OUTLIER -48.37 -50.03 59.52 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.127 179.85 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 140' ' ' GLU . 72.0 Cg_exo -48.83 -24.41 7.04 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.582 2.188 . . . . 0.0 112.555 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 8.1 mtt85 65.31 153.37 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.906 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.418 ' CD2' ' HD3' ' A' ' 158' ' ' ARG . 58.3 m-85 -82.25 127.6 33.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.942 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 1.045 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.3 OUTLIER -84.96 112.67 20.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.71 179.888 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.423 ' HG3' ' CE2' ' A' ' 156' ' ' PHE . 1.8 tt0 -108.12 131.23 54.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.986 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.405 HG12 HG23 ' A' ' 130' ' ' VAL . 35.6 mt -132.32 110.98 17.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.189 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.459 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 30.7 p -91.66 155.36 18.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.908 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.804 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -132.89 145.83 51.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.105 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.765 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -94.54 30.51 1.98 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.289 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -119.41 47.04 1.77 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.171 0.51 . . . . 0.0 110.115 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 120.23 17.06 4.57 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.266 -179.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.4 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 2.8 mm-40 61.11 63.95 1.18 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.049 0.452 . . . . 0.0 110.91 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.804 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 28.1 m-20 -91.07 162.69 14.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.818 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -167.28 96.04 0.48 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.157 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 9.4 m -90.63 124.97 43.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.199 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.423 ' CE2' ' HG3' ' A' ' 145' ' ' GLU . 0.5 OUTLIER -105.96 87.13 2.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.807 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.46 HD13 HD21 ' A' ' 32' ' ' LEU . 2.2 mt -99.86 171.25 7.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.98 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.418 ' HD3' ' CD2' ' A' ' 143' ' ' TYR . 6.5 ttp85 -143.58 116.33 8.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.884 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -70.84 172.87 8.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.205 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.74 -31.38 13.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.009 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -110.89 157.52 19.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.868 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -73.83 -57.12 4.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.851 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -61.08 -32.45 72.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.075 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 2.9 m -64.62 -52.58 56.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.8 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.884 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -59.67 -36.89 77.35 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.051 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -45.23 60.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.365 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 59.8 p -66.52 -32.4 73.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.1 179.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.592 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.1 m95 -72.56 -49.88 29.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.743 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 1.045 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -58.92 -47.33 85.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.314 0.578 . . . . 0.0 110.385 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -59.7 -40.89 97.13 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.525 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.91 -40.29 72.24 Favored 'General case' 0 CA--C 1.51 -0.592 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.894 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.863 HG22 HD12 ' A' ' 176' ' ' ILE . 10.9 mt -60.98 -24.51 33.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 177.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.557 ' N ' HG11 ' A' ' 130' ' ' VAL . 19.5 tt0 -85.3 -25.91 26.91 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.507 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.83 -42.49 73.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.196 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -76.01 -39.99 54.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.814 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.863 HD12 HG22 ' A' ' 172' ' ' ILE . 67.4 mt -80.7 -9.46 12.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.362 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -86.2 26.1 6.49 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.449 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.6 t . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.171 -0.919 . . . . 0.0 111.011 179.951 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.836 0.351 . . . . 0.0 111.081 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.4 p -109.69 -178.12 3.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -87.17 -37.4 8.33 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.472 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.46 154.32 46.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.782 0.325 . . . . 0.0 110.926 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.2 158.94 15.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -125.88 84.06 61.67 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.027 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.13 142.16 45.59 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.623 2.215 . . . . 0.0 112.45 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -86.26 136.63 33.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.697 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.738 HG22 ' HA ' ' A' ' 33' ' ' SER . 34.0 p -136.45 148.39 47.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.954 0.407 . . . . 0.0 111.35 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.26 162.36 30.15 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.194 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.802 HD13 ' NH1' ' A' ' 29' ' ' ARG . 7.3 mt -82.98 132.93 35.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.791 0.329 . . . . 0.0 110.989 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.627 HD22 ' CB ' ' A' ' 157' ' ' LEU . 0.2 OUTLIER -146.87 145.52 29.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.738 179.815 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -79.84 158.33 26.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.104 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 12.6 tp -141.89 128.97 20.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.411 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.469 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 29.5 ttp180 -69.59 67.0 0.22 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.894 0.378 . . . . 0.0 110.904 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.04 169.25 1.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.901 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -177.48 137.28 3.38 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.511 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -163.79 143.63 8.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.859 0.361 . . . . 0.0 111.124 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 139.41 -145.52 16.72 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.477 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 p -123.07 139.93 53.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.811 0.339 . . . . 0.0 110.954 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.18 -135.06 12.0 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.454 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.06 -45.68 0.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.922 0.392 . . . . 0.0 111.172 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -87.49 84.69 1.52 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.471 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 177.94 62.7 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.514 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -87.3 152.77 22.0 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.873 0.368 . . . . 0.0 110.926 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.2 mtp180 -138.32 115.37 10.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.915 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.469 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 39.6 m95 -69.23 163.71 24.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.934 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -160.74 152.66 19.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.959 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.802 ' NH1' HD13 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -77.54 120.14 22.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.921 179.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.401 HG21 ' HB2' ' A' ' 14' ' ' LEU . 33.3 m -130.1 133.86 63.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.062 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 12.0 tp -74.7 143.34 44.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.758 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.555 HD13 ' HB2' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -111.33 137.03 49.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.957 -179.845 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.738 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.8 OUTLIER -118.56 94.4 4.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.799 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.486 HD22 HD13 ' A' ' 172' ' ' ILE . 7.6 tp -89.31 115.3 26.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.962 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.406 ' N ' HD12 ' A' ' 34' ' ' LEU . . . -117.89 149.11 41.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.702 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.82 -15.54 31.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.31 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.401 ' O ' ' HB2' ' A' ' 38' ' ' ALA . 3.2 p30 -95.29 -26.85 15.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.236 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.681 ' HA ' HD13 ' A' ' 125' ' ' LEU . . . 179.05 171.65 0.86 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.806 0.336 . . . . 0.0 111.302 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.582 ' HB3' HG23 ' A' ' 123' ' ' VAL . 3.2 tm? -106.25 115.42 30.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.709 179.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.8 m -116.72 123.38 47.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.15 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.541 HG13 HD12 ' A' ' 32' ' ' LEU . 16.9 t -103.81 159.58 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.894 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.49 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.4 OUTLIER -167.34 166.47 8.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.783 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.407 ' HD3' HD22 ' A' ' 117' ' ' LEU . 34.6 Cg_endo -64.52 148.26 90.54 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.577 2.185 . . . . 0.0 112.259 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.578 ' HB1' HD21 ' A' ' 11' ' ' LEU . . . -98.41 45.66 1.01 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.054 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -88.38 66.99 8.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.905 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 69.0 164.87 3.75 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.485 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -96.91 103.34 14.56 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.61 0.243 . . . . 0.0 110.967 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.0 121.5 7.92 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.442 2.095 . . . . 0.0 112.25 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 143.5 -68.86 0.43 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.519 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.5 54.32 4.97 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.695 2.263 . . . . 0.0 112.534 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 178.26 75.34 0.13 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.804 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -51.47 167.23 0.4 Allowed 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.633 2.222 . . . . 0.0 112.408 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.92 70.18 0.98 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.873 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -57.66 142.98 95.96 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.501 2.134 . . . . 0.0 112.191 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -162.47 123.73 2.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.165 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -114.32 143.37 44.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.806 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -165.41 38.25 0.06 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.931 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -117.46 104.99 11.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.884 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -160.86 30.93 0.35 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.617 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -124.14 122.65 38.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.844 0.354 . . . . 0.0 111.147 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.96 140.43 55.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.033 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.92 162.25 44.72 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.999 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -68.23 107.15 1.5 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.524 2.15 . . . . 0.0 112.316 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.36 70.36 0.29 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.571 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -92.32 76.09 5.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.87 0.366 . . . . 0.0 110.922 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.764 ' HB3' ' HD3' ' A' ' 67' ' ' PRO . . . -179.2 -61.76 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.242 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.764 ' HD3' ' HB3' ' A' ' 66' ' ' ALA . 43.2 Cg_endo -69.37 152.56 71.31 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.843 2.362 . . . . 0.0 112.277 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -73.71 150.91 45.7 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.661 2.241 . . . . 0.0 112.365 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -140.26 109.38 6.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.918 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.537 ' H ' HD12 ' A' ' 70' ' ' LEU . 1.3 mp -81.65 -46.54 1.06 Allowed Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.696 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 70' ' ' LEU . 90.9 Cg_endo -81.87 -168.2 0.58 Allowed 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.619 2.212 . . . . 0.0 112.505 -179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 65.79 72.63 0.4 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.495 0.664 . . . . 0.0 110.528 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 178.88 -48.82 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.866 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 10.2 mp -88.37 -27.64 21.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.871 178.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.869 HD22 ' O ' ' A' ' 75' ' ' LEU . 0.1 OUTLIER -75.39 -34.62 61.1 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.223 179.479 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.582 ' N ' HD13 ' A' ' 75' ' ' LEU . 0.7 OUTLIER -87.73 51.84 2.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.981 179.823 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -115.08 30.38 7.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.02 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -78.46 -48.77 14.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.993 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -85.5 57.36 4.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.777 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.4 t -135.15 -46.81 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.191 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.485 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -80.4 -49.83 1.15 Allowed Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.15 -179.912 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 81' ' ' SER . 48.5 Cg_endo -93.37 -141.44 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.09 0 C-N-CA 123.684 2.923 . . . . 0.0 111.653 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -69.95 161.1 30.66 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.864 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -129.21 159.46 36.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.997 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 9.3 mttp -122.68 -41.09 2.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.004 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 64.38 173.34 0.19 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.933 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.8 p -139.29 -52.48 0.55 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.915 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -77.72 -36.32 51.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.068 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -98.92 -152.36 27.53 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.479 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 96.88 -44.19 1.95 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.462 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.9 t -144.68 154.16 42.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.833 0.349 . . . . 0.0 110.807 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.48 138.55 36.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.92 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.3 p -80.88 129.65 37.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.082 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 170.82 93.74 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.508 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 60.29 80.08 0.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.752 0.31 . . . . 0.0 110.876 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -179.64 75.46 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.74 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 86.7 p -67.47 135.51 93.03 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.783 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.93 112.44 3.5 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.509 2.139 . . . . 0.0 112.323 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -56.07 -27.44 64.73 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.401 2.067 . . . . 0.0 112.282 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.15 -174.25 4.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.1 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -157.57 165.06 19.52 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.902 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.79 -179.35 1.27 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.525 2.15 . . . . 0.0 112.251 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 12.7 mt 61.29 155.05 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.883 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -129.28 -45.47 1.23 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.872 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.71 36.0 16.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.899 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.22 130.91 21.43 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.873 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.19 107.28 0.19 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.431 2.088 . . . . 0.0 112.232 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.2 m -88.18 -46.67 9.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.966 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.2 m 61.08 155.75 0.11 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.803 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -66.84 144.85 72.66 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.533 2.155 . . . . 0.0 112.217 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -179.69 -80.41 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.537 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.78 159.9 4.51 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.532 2.155 . . . . 0.0 112.272 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.8 119.82 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.904 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.75 166.2 0.92 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.371 2.048 . . . . 0.0 112.245 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 69.8 mtt85 -90.21 154.2 19.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.953 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -92.16 -51.36 5.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.875 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.407 HD22 ' HD3' ' A' ' 43' ' ' PRO . 0.5 OUTLIER -123.3 87.16 2.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.916 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.0 m -95.28 -33.08 12.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.837 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -97.16 148.52 22.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.93 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.481 ' HB3' ' NE2' ' A' ' 122' ' ' HIS . . . -96.75 166.46 11.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.106 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -105.52 92.55 4.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.834 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.481 ' NE2' ' HB3' ' A' ' 120' ' ' ALA . 7.3 m-70 -93.77 109.49 21.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.198 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.593 HG12 ' CB ' ' A' ' 148' ' ' ALA . 0.6 OUTLIER -116.55 121.83 68.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.762 179.64 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 10.6 t -56.57 140.09 47.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.826 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.681 HD13 ' HA ' ' A' ' 38' ' ' ALA . 1.9 mp -97.39 31.11 2.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.981 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 mtmm -133.65 32.18 3.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.531 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.584 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 0.0 OUTLIER -177.55 -36.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.83 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.561 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -54.94 -172.34 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.172 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -168.77 120.65 0.78 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.843 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.578 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.0 p -94.38 159.12 2.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.196 0.522 . . . . 0.0 111.123 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.468 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 13.6 t -164.46 155.11 14.85 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.846 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 21.2 ttp180 -121.52 84.04 2.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.642 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.02 163.36 26.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.899 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 1.3 t -110.49 140.18 45.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.895 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.81 164.28 47.48 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.773 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.07 -15.49 48.79 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.57 2.18 . . . . 0.0 112.48 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 43.9 p -96.68 -31.85 12.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.846 0.355 . . . . 0.0 110.943 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 60.14 65.76 2.2 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.887 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -63.24 -66.32 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.619 2.213 . . . . 0.0 112.346 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.428 ' N ' ' HD2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER 179.18 -61.09 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.998 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' A' ' 140' ' ' GLU . 39.5 Cg_endo -66.81 -10.44 28.27 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.577 2.185 . . . . 0.0 112.688 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? 66.1 -173.94 0.18 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.796 0.331 . . . . 0.0 111.028 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -108.33 118.21 36.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.056 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 1.042 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.9 OUTLIER -96.79 119.61 35.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.695 179.662 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.428 ' HG3' ' CE1' ' A' ' 156' ' ' PHE . 9.0 tt0 -125.81 138.22 53.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.066 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.507 HD13 HG21 ' A' ' 172' ' ' ILE . 14.2 mt -134.95 112.8 15.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.073 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.561 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 18.5 m -88.48 162.07 16.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.03 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.687 ' HB3' ' HB3' ' A' ' 153' ' ' ASP . . . -144.09 146.51 32.86 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.171 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.584 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.03 30.24 2.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.337 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.22 45.47 1.76 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.131 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 117.05 23.01 4.03 Favored Glycine 0 N--CA 1.449 -0.459 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.14 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.409 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 3.8 mm-40 58.78 61.93 2.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 121.096 0.474 . . . . 0.0 110.84 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.687 ' HB3' ' HB3' ' A' ' 148' ' ' ALA . 20.2 t0 -88.66 161.95 16.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.883 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -168.38 89.82 0.26 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.144 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.481 HG22 ' HB ' ' A' ' 146' ' ' ILE . 30.2 m -77.5 132.89 31.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.127 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.428 ' CE1' ' HG3' ' A' ' 145' ' ' GLU . 68.0 m-85 -111.03 92.04 3.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.647 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.627 ' CB ' HD22 ' A' ' 12' ' ' LEU . 1.8 mt -104.04 160.19 15.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.19 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.468 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 2.9 ttt180 -133.38 97.17 3.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.828 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.948 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -54.34 171.28 0.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.247 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.85 -31.05 11.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.841 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -108.36 171.53 7.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.861 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.27 -55.65 3.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.967 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.41 -28.17 68.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.206 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -52.27 37.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.7 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.948 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -61.47 -37.43 83.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.949 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -73.19 -44.04 60.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.311 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 24.8 t -66.42 -33.24 75.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.874 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.444 ' O ' HG12 ' A' ' 172' ' ' ILE . 11.5 m95 -72.5 -52.49 15.49 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.75 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 1.042 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -56.24 -45.87 79.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.291 0.567 . . . . 0.0 110.467 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.9 -44.54 96.01 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.527 -0.761 . . . . 0.0 112.734 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.09 -40.81 82.57 Favored 'General case' 0 CA--C 1.51 -0.571 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.176 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.785 HG22 HD12 ' A' ' 176' ' ' ILE . 20.8 mm -60.4 -24.91 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.578 ' N ' HG11 ' A' ' 130' ' ' VAL . 30.8 tt0 -83.63 -26.15 30.18 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.571 179.416 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.66 -49.31 63.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.21 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . 0.657 ' HB3' HD23 ' A' ' 125' ' ' LEU . 1.9 mp0 -69.65 -41.26 75.82 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.787 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.785 HD12 HG22 ' A' ' 172' ' ' ILE . 67.5 mt -80.05 -3.03 5.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.378 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -87.0 25.3 7.78 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.643 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.3 t . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.362 -0.828 . . . . 0.0 110.95 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.813 0.34 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m 60.76 177.13 0.1 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.971 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 148.44 -110.18 0.48 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.459 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.05 40.64 14.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.837 0.351 . . . . 0.0 110.932 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.3 mmt180 -142.59 103.32 4.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.858 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -132.13 90.71 34.13 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.149 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.55 156.42 63.94 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.598 2.199 . . . . 0.0 112.351 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.44 146.19 36.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.786 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.881 HG22 ' HA ' ' A' ' 33' ' ' SER . 58.8 p -140.44 152.95 46.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.095 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -158.63 123.9 1.31 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.328 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 18.4 mt -64.28 100.73 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.875 0.369 . . . . 0.0 110.926 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.759 HD13 HD22 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -106.61 170.03 8.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.895 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.536 ' O ' HD23 ' A' ' 157' ' ' LEU . 0.2 OUTLIER -107.88 155.97 19.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.979 -179.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 13.2 tp -134.37 127.8 32.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.638 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.43 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.7 OUTLIER -69.35 175.2 4.12 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.852 -179.539 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.5 t -166.79 98.14 0.55 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.95 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -150.68 66.16 0.36 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.515 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.21 179.99 3.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.843 0.354 . . . . 0.0 111.101 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.05 53.74 3.61 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.503 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.76 -55.8 3.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.854 0.359 . . . . 0.0 110.86 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 174.07 -48.81 0.15 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.461 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -99.16 89.56 4.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.799 0.333 . . . . 0.0 111.137 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -104.29 82.02 0.35 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.465 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -122.24 36.34 3.21 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.518 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 60.83 88.24 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.874 0.369 . . . . 0.0 110.906 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.1 63.03 0.75 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.788 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.477 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 46.6 m95 -58.7 160.28 5.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.962 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -147.39 152.61 38.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.018 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -80.63 121.32 25.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.041 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.666 HG12 ' HA ' ' A' ' 43' ' ' PRO . 31.9 m -134.52 137.82 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.135 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tp -86.16 127.8 34.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.616 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.759 HD22 HD13 ' A' ' 12' ' ' LEU . 0.9 OUTLIER -100.16 103.44 14.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.015 -179.768 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.881 ' HA ' HG22 ' A' ' 9' ' ' THR . 2.7 m -82.24 78.57 8.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.657 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.848 HD12 ' HG ' ' A' ' 39' ' ' LEU . 3.6 tp -74.48 93.29 2.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.17 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.46 147.8 22.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.916 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.2 -14.76 52.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.512 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.41 -17.33 14.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.237 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.423 ' C ' HD22 ' A' ' 125' ' ' LEU . . . -174.23 173.71 3.02 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.78 0.324 . . . . 0.0 111.128 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.848 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -121.37 104.63 9.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.895 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.504 HG23 ' CD2' ' A' ' 122' ' ' HIS . 21.3 m -101.45 155.03 18.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.041 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.643 HG13 HD12 ' A' ' 32' ' ' LEU . 16.2 t -138.78 159.11 30.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.147 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.485 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -165.19 158.33 13.92 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.542 179.92 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.666 ' HA ' HG12 ' A' ' 30' ' ' VAL . 6.6 Cg_exo -73.85 42.02 0.68 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.768 2.312 . . . . 0.0 112.78 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 46.05 29.83 0.84 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.032 0.444 . . . . 0.0 111.302 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -84.78 149.52 25.69 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.911 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -85.71 67.57 3.55 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.415 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -80.58 131.78 60.23 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.574 0.226 . . . . 0.0 110.765 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -53.41 144.07 51.88 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.438 2.092 . . . . 0.0 112.26 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -99.16 -74.27 1.13 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.49 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.83 113.03 3.41 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.64 2.227 . . . . 0.0 112.336 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 60.84 83.3 0.21 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.048 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.79 108.37 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.522 2.148 . . . . 0.0 112.284 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.51 143.67 97.83 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.921 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -73.91 150.36 43.75 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.531 2.154 . . . . 0.0 112.325 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 59.27 -169.11 0.14 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.2 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -157.49 53.24 0.48 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.968 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.63 HD13 ' H ' ' A' ' 58' ' ' ASN . 0.2 OUTLIER 62.1 151.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.901 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.63 ' H ' HD13 ' A' ' 57' ' ' LEU . 34.5 p30 -129.12 62.88 1.5 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.872 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.481 ' O ' HD12 ' A' ' 57' ' ' LEU . . . 136.98 141.42 4.25 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.524 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -144.17 177.65 8.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.814 0.34 . . . . 0.0 111.121 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -150.46 145.8 26.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.124 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -136.88 154.42 76.22 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.853 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.48 113.52 2.52 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.507 2.138 . . . . 0.0 112.267 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.19 -109.03 2.74 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.473 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -160.54 118.55 2.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.812 0.339 . . . . 0.0 111.083 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.57 159.4 84.69 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.026 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.21 159.04 4.54 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.531 2.154 . . . . 0.0 112.351 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.01 179.85 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.61 2.207 . . . . 0.0 112.25 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -86.22 134.8 33.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.856 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.2 mp -70.57 168.54 19.02 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.766 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -56.39 -165.02 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.537 2.158 . . . . 0.0 112.269 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.7 mt-10 64.94 70.99 0.46 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.3 0.571 . . . . 0.0 110.72 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 167.82 -46.26 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.735 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.409 ' N ' HD12 ' A' ' 74' ' ' LEU . 7.8 mp -93.67 -34.64 13.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.941 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.671 HD12 ' N ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -64.31 -15.7 60.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.444 -179.912 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.671 ' N ' HD12 ' A' ' 75' ' ' LEU . 0.4 OUTLIER -91.21 -35.11 14.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.825 0.345 . . . . 0.0 110.869 179.961 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -109.56 82.96 1.68 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.954 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -110.62 -7.13 14.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.397 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.51 39.87 1.12 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.985 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.2 t -127.56 -28.19 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.528 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.471 ' N ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -52.85 -52.68 62.54 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.742 -179.703 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.471 ' HD2' ' N ' ' A' ' 81' ' ' SER . 73.6 Cg_endo -78.78 53.27 4.57 Favored 'Trans proline' 0 N--CA 1.465 -0.192 0 C-N-CA 122.894 2.396 . . . . 0.0 113.01 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 42.44 31.87 0.31 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.66 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -102.85 160.9 14.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.809 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.8 mttt -114.93 -68.42 0.92 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.997 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -169.21 -43.0 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.3 p -149.59 31.02 0.73 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.896 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 58.91 88.61 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.089 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -170.68 62.8 0.17 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.534 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -137.42 -170.13 11.81 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.562 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.8 t -134.15 152.97 52.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.762 0.315 . . . . 0.0 110.897 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.84 143.47 57.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.905 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.15 149.92 11.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.087 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -132.09 -82.12 0.22 Allowed Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.487 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER 59.77 78.6 0.26 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.87 0.367 . . . . 0.0 110.834 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -157.31 31.67 0.28 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.956 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.1 m -108.46 129.9 23.44 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.86 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.501 ' N ' ' CD ' ' A' ' 99' ' ' PRO . 31.9 Cg_exo -56.58 -45.91 33.7 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.358 2.038 . . . . 0.0 112.634 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.501 ' CD ' ' N ' ' A' ' 98' ' ' PRO . 83.1 Cg_endo -85.13 51.75 3.16 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.943 2.429 . . . . 0.0 112.393 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.16 102.95 11.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.082 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 2.3 t -110.55 87.21 6.23 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.936 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -68.52 81.42 0.56 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.559 2.173 . . . . 0.0 112.301 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.415 ' O ' HD12 ' A' ' 103' ' ' LEU . 2.5 pp -170.63 117.03 0.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.935 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -160.92 30.56 0.15 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.927 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 2.1 mtm180 -137.93 131.26 30.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.819 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.461 ' CB ' ' CD ' ' A' ' 107' ' ' PRO . 9.8 mm100 -160.85 -65.65 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.958 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 106' ' ' GLN . 55.9 Cg_endo -69.93 -9.89 27.13 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.341 2.027 . . . . 0.0 112.611 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.2 p -56.85 154.48 9.24 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.802 0.334 . . . . 0.0 111.003 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -106.08 116.91 58.75 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.816 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -73.94 155.01 48.3 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.502 2.135 . . . . 0.0 112.454 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 147.38 71.97 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.586 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -63.63 76.04 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.705 2.27 . . . . 0.0 112.188 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -102.18 133.13 20.8 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.873 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.48 175.5 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.409 2.073 . . . . 0.0 112.245 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.44 94.75 9.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.874 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.867 ' HB3' HD23 ' A' ' 117' ' ' LEU . 2.9 m120 -139.55 -75.19 0.36 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.888 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.867 HD23 ' HB3' ' A' ' 116' ' ' ASN . 0.5 OUTLIER -151.16 123.5 8.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.959 -179.973 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 43.4 m -110.18 -31.4 7.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.806 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.84 22.62 10.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.143 0.497 . . . . 0.0 111.148 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.426 ' HB3' ' CE1' ' A' ' 122' ' ' HIS . . . 63.35 143.19 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.181 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.519 ' HE2' HG13 ' A' ' 155' ' ' VAL . 5.5 tttp -84.47 95.28 8.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.767 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.504 ' CD2' HG23 ' A' ' 40' ' ' THR . 73.3 m80 -91.16 103.11 15.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.089 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 39' ' ' LEU . 6.6 t -81.81 118.06 28.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.725 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -49.25 -34.55 15.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.516 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.614 HD13 ' HB2' ' A' ' 39' ' ' LEU . 3.8 tp 60.22 -165.21 0.21 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.665 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 54.88 38.78 30.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.991 0.424 . . . . 0.0 110.773 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.7 mtt 173.42 -30.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.762 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.06 -167.75 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.296 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.448 ' CD1' ' N ' ' A' ' 129' ' ' TYR . 0.0 OUTLIER -159.77 120.13 3.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.62 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.657 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.4 p -94.52 159.53 2.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.31 0.576 . . . . 0.0 111.272 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.481 ' N ' HG22 ' A' ' 130' ' ' VAL . 1.0 OUTLIER -169.1 125.46 0.92 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.862 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 -95.89 86.65 4.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.967 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -73.75 -179.77 3.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.881 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 20.5 m -134.75 116.34 14.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.844 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.413 HG23 ' CD1' ' A' ' 143' ' ' TYR . 7.4 p -59.32 156.17 31.4 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.978 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_exo -51.32 -25.17 17.45 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.67 2.247 . . . . 0.0 112.405 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 48.5 p -83.48 -41.15 18.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.998 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 56.55 62.58 6.25 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.975 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.01 -54.85 0.29 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.419 2.08 . . . . 0.0 112.58 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.47 ' N ' ' HD2' ' A' ' 141' ' ' PRO . 0.5 OUTLIER 176.22 -61.54 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.223 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 140' ' ' GLU . 12.2 Cg_endo -55.72 -20.73 29.26 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.547 2.165 . . . . 0.0 112.47 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 66.18 -166.69 0.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.743 0.306 . . . . 0.0 110.852 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.413 ' CD1' HG23 ' A' ' 135' ' ' THR . 0.1 OUTLIER -118.9 120.31 36.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.849 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.465 HD11 ' HA ' ' A' ' 165' ' ' ALA . 0.2 OUTLIER -99.17 109.2 21.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.734 179.95 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -114.36 142.32 46.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.735 HD13 HG21 ' A' ' 172' ' ' ILE . 24.0 mt -146.31 107.18 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.91 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 11.7 m -92.77 133.38 36.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.052 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.68 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -108.5 150.21 27.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.406 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -95.24 30.69 2.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.294 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -116.3 45.78 1.71 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.075 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.22 23.49 3.2 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.145 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.412 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.5 mm-40 57.16 59.59 3.34 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.07 0.462 . . . . 0.0 111.084 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.68 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.8 m-20 -85.74 158.61 19.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.545 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -157.98 91.66 1.13 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.206 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.519 HG13 ' HE2' ' A' ' 121' ' ' LYS . 6.6 m -92.02 117.87 36.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.219 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -110.26 83.18 1.71 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.778 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.536 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.3 mt -90.35 166.58 13.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.034 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.463 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 24.0 ttp180 -131.28 105.9 7.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.793 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.799 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -56.67 170.13 0.42 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.271 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.76 -30.49 20.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.988 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -119.11 168.87 10.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.931 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -78.02 -57.37 3.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.872 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -58.77 -35.38 72.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.173 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 168' ' ' TRP . 16.8 p -61.33 -51.89 66.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.919 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.799 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -58.67 -39.03 79.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.191 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.21 -45.42 66.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.716 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 4.9 m -67.42 -32.58 73.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.007 0.432 . . . . 0.0 110.254 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.728 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 5.1 m95 -72.98 -47.86 41.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.828 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.535 ' HA ' HD12 ' A' ' 172' ' ' ILE . . . -56.79 -58.57 7.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.315 0.579 . . . . 0.0 110.164 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -53.31 -40.13 60.11 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.558 -0.747 . . . . 0.0 112.588 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.35 -41.02 81.31 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.791 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.735 HG21 HD13 ' A' ' 146' ' ' ILE . 10.8 mt -59.64 -24.0 27.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 177.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.657 ' N ' HG11 ' A' ' 130' ' ' VAL . 11.5 tt0 -77.39 -37.57 51.73 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.013 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . 0.417 ' HA ' ' CG2' ' A' ' 178' ' ' THR . . . -59.35 -47.68 84.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.538 179.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -37.29 77.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.063 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.479 HD12 HG22 ' A' ' 172' ' ' ILE . 49.3 mt -68.29 -29.15 43.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.039 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.535 ' O ' HG22 ' A' ' 178' ' ' THR . . . 152.02 -47.47 0.57 Allowed Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.398 -0.906 . . . . 0.0 112.936 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 177' ' ' GLY . 9.6 t . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.304 -0.855 . . . . 0.0 111.349 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.799 0.333 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.2 t 60.79 102.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.889 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 173.29 75.48 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.506 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -38.53 91.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.726 0.298 . . . . 0.0 110.887 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.98 88.3 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.775 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -125.71 138.94 32.93 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.209 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -73.6 153.17 49.1 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.591 2.194 . . . . 0.0 112.375 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -93.83 142.24 27.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.823 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.92 HG22 ' HA ' ' A' ' 33' ' ' SER . 38.1 p -140.77 161.61 37.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.943 0.402 . . . . 0.0 111.213 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.56 140.41 5.55 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.356 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 26.8 mt -61.14 120.72 10.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.927 0.394 . . . . 0.0 110.959 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.806 HD13 HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -132.78 154.94 49.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.743 179.915 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.54 160.25 20.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.905 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 46.1 tp -141.31 126.44 18.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.632 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.437 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 2.4 ttm180 -69.34 178.37 2.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.618 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -162.18 93.96 0.89 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.852 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -136.37 138.45 9.87 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.51 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -167.03 -171.38 1.77 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.774 0.321 . . . . 0.0 111.235 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.28 -136.04 19.62 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.577 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.1 m -60.99 -171.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.753 0.311 . . . . 0.0 110.987 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -97.0 29.4 10.71 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.542 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -79.52 170.9 15.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.765 0.317 . . . . 0.0 110.987 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -110.37 42.03 2.08 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.582 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -105.82 42.83 1.81 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.381 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -68.52 179.27 1.73 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.791 0.329 . . . . 0.0 111.032 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.33 -174.51 3.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.813 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.438 ' CH2' ' HB2' ' A' ' 158' ' ' ARG . 31.3 m95 -149.17 160.86 42.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.755 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.51 168.71 26.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.839 0.352 . . . . 0.0 111.068 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 -92.24 137.01 32.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.975 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 30' ' ' VAL . 29.3 m -156.44 120.77 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.021 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.2 tp -69.73 128.24 35.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.703 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.806 HD22 HD13 ' A' ' 12' ' ' LEU . 7.5 mp -92.98 139.73 30.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.99 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.92 ' HA ' HG22 ' A' ' 9' ' ' THR . 3.3 t -113.48 77.43 1.05 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.681 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.5 ' HA ' HD22 ' A' ' 39' ' ' LEU . 7.5 tp -72.99 96.25 2.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.86 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -96.29 148.09 23.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.905 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.26 -13.45 38.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.511 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -103.45 -19.03 14.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.391 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.703 ' HA ' HD13 ' A' ' 125' ' ' LEU . . . -176.2 174.42 2.02 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.968 0.413 . . . . 0.0 111.38 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.539 ' C ' HD13 ' A' ' 39' ' ' LEU . 3.0 tm? -112.94 93.94 4.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.67 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.407 HG23 ' CD2' ' A' ' 122' ' ' HIS . 20.8 m -98.99 134.74 41.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.94 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.636 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 13.1 t -106.27 158.59 6.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.98 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.449 ' N ' HG12 ' A' ' 41' ' ' VAL . 14.9 p -146.56 152.12 44.7 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.787 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.72 44.48 1.43 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.611 2.207 . . . . 0.0 112.688 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 48.17 28.82 1.64 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.097 0.475 . . . . 0.0 111.188 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -57.85 102.45 0.1 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.916 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 137.52 85.06 0.15 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.556 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.9 mp0 -92.28 147.6 34.87 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.705 0.288 . . . . 0.0 111.019 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.43 165.05 33.51 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.64 2.227 . . . . 0.0 112.214 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 62.26 115.91 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.447 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -51.31 99.7 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.477 2.118 . . . . 0.0 112.286 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -140.51 93.88 8.59 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.958 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -52.8 -173.64 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.541 2.161 . . . . 0.0 112.334 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.65 163.31 2.76 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.982 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -64.24 -175.58 0.33 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.533 2.155 . . . . 0.0 112.303 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.31 134.88 29.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.125 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -89.61 87.25 6.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.942 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 5.3 mt -80.4 -31.56 37.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.914 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -89.16 121.6 31.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.871 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -131.58 97.06 0.34 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.503 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -141.05 129.09 21.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.815 0.34 . . . . 0.0 111.141 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 59.83 93.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.038 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -55.12 107.39 0.86 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.06 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -60.51 132.18 42.01 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.424 2.083 . . . . 0.0 112.223 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.39 -44.33 7.49 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.376 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -120.49 179.61 4.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.76 0.314 . . . . 0.0 111.029 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -93.35 129.94 37.25 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.106 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -74.43 155.14 45.76 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.495 2.13 . . . . 0.0 112.337 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -53.11 -174.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.553 2.169 . . . . 0.0 112.224 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.8 160.16 17.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.909 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.48 152.51 57.71 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.917 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -51.72 114.32 1.54 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.602 2.201 . . . . 0.0 112.348 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -152.55 68.33 0.84 Allowed 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.984 0.897 . . . . 0.0 110.719 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 178.09 -60.38 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 113.865 -1.516 . . . . 0.0 109.878 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.569 HD21 ' HE1' ' A' ' 84' ' ' PHE . 1.4 tt -90.01 -21.42 22.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.949 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.847 HD22 ' O ' ' A' ' 75' ' ' LEU . 0.1 OUTLIER -85.87 -35.96 20.25 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.462 179.764 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.553 ' N ' HD13 ' A' ' 75' ' ' LEU . 1.5 tp -53.55 -27.43 26.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.221 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -57.53 -85.62 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.848 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.1 ttp85 74.15 -52.95 0.69 Allowed 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.08 56.2 0.32 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.986 0.422 . . . . 0.0 111.117 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 26.0 t -143.36 -45.21 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.869 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.443 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -139.48 123.31 10.92 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.748 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 81' ' ' SER . 15.3 Cg_exo -68.67 54.04 0.79 Allowed 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.669 2.246 . . . . 0.0 112.547 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.3 t80 176.18 39.13 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.742 0.306 . . . . 0.0 110.73 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.569 ' HE1' HD21 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -84.75 91.43 7.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.852 -179.87 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.4 ptpt -172.89 170.47 4.54 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.89 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -130.4 169.01 16.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.792 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.44 -42.37 4.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.871 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -87.82 155.2 20.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.106 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 160.15 80.28 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.461 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -131.41 -136.53 3.91 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.474 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.6 t -167.03 159.61 13.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.834 0.35 . . . . 0.0 110.881 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.5 m -82.74 114.82 21.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.478 HG22 ' N ' ' A' ' 94' ' ' GLY . 11.1 p -65.06 158.46 4.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.989 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.478 ' N ' HG22 ' A' ' 93' ' ' VAL . . . -76.88 -104.1 0.15 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.501 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -158.46 74.76 0.7 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.884 0.373 . . . . 0.0 110.946 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 59.51 37.25 22.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.984 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.1 t -102.24 93.49 3.96 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.932 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -68.37 111.16 2.44 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.569 2.179 . . . . 0.0 112.327 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.37 -27.43 7.88 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.484 2.122 . . . . 0.0 112.352 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -136.36 103.72 5.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.124 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 3.2 p -81.34 116.43 62.74 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.864 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.14 62.47 4.15 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.442 2.095 . . . . 0.0 112.239 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.637 HD12 ' N ' ' A' ' 104' ' ' GLN . 1.4 pp -151.48 -45.91 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.996 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.637 ' N ' HD12 ' A' ' 103' ' ' LEU . 1.1 mt-30 -88.32 -45.2 10.22 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.832 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.81 149.26 24.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.918 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -98.24 100.93 9.91 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.837 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -67.98 123.47 10.7 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.406 2.071 . . . . 0.0 112.278 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 2.5 t -171.67 92.68 0.14 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.87 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.3 m 61.12 91.72 0.07 OUTLIER Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -68.14 155.6 68.9 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.515 2.143 . . . . 0.0 112.325 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -106.9 102.17 1.82 Allowed Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.455 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -50.26 148.63 13.85 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.526 2.151 . . . . 0.0 112.411 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.6 pm0 -87.55 156.22 53.48 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.836 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.33 115.56 3.24 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.639 2.226 . . . . 0.0 112.177 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 58.8 mtp180 -147.06 42.85 1.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.894 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -147.39 -55.2 0.23 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.866 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -162.43 105.19 1.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.856 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.35 133.61 34.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.854 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 61.16 166.53 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.636 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -84.54 164.69 18.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.198 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.401 ' HE2' ' CG1' ' A' ' 155' ' ' VAL . 44.8 tttp -105.38 84.74 2.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.89 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.407 ' CD2' HG23 ' A' ' 40' ' ' THR . 10.5 m-70 -73.84 92.21 2.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.866 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.481 ' O ' ' HB1' ' A' ' 38' ' ' ALA . 27.4 t -85.97 120.44 35.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.171 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 1.7 m -68.53 131.85 45.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.88 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.703 HD13 ' HA ' ' A' ' 38' ' ' ALA . 1.2 mp -87.88 -168.19 2.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.857 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.441 ' HG3' HG23 ' A' ' 178' ' ' THR . 0.0 OUTLIER 62.07 32.69 17.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.761 -179.844 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.641 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 3.2 mtt -171.04 -41.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.001 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.23 -169.69 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.138 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.467 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.3 OUTLIER -170.2 122.88 0.68 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.472 179.797 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.601 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.3 p -96.45 158.8 3.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.342 0.591 . . . . 0.0 111.539 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.474 ' N ' HG22 ' A' ' 130' ' ' VAL . 15.8 m -151.93 166.4 31.61 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.645 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.2 ttp180 -134.04 85.8 2.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.062 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.58 -168.12 0.79 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.872 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 53.8 m -122.51 132.59 54.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.916 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.554 HG23 ' CE2' ' A' ' 143' ' ' TYR . 0.2 OUTLIER -95.06 136.76 22.48 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.023 -179.934 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -79.26 -27.2 4.53 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.585 2.19 . . . . 0.0 112.568 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 20.4 p -79.37 -34.8 41.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.271 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -130.59 97.69 21.19 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.883 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.58 61.81 8.07 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.591 2.194 . . . . 0.0 112.751 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.518 ' CB ' ' HD3' ' A' ' 141' ' ' PRO . 1.7 mt-10 -169.66 -60.48 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.033 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.518 ' HD3' ' CB ' ' A' ' 140' ' ' GLU . 50.7 Cg_exo -53.08 -29.78 46.67 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.281 1.987 . . . . 0.0 112.141 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 62.94 152.95 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.84 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.554 ' CE2' HG23 ' A' ' 135' ' ' THR . 0.1 OUTLIER -89.46 132.91 34.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.879 -179.857 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.653 HD21 ' HB2' ' A' ' 169' ' ' ALA . 0.4 OUTLIER -111.6 115.14 28.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.581 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -117.66 136.46 53.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.055 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.619 HD13 HG21 ' A' ' 172' ' ' ILE . 28.7 mt -135.94 104.24 4.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.978 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 29.7 m -90.1 136.42 33.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.957 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -114.65 150.8 34.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.041 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.641 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -94.06 30.92 1.76 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.5 -179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -110.67 42.81 1.52 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.035 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.68 25.71 2.54 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.118 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.417 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 5.8 mm-40 56.75 59.42 3.54 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.035 0.445 . . . . 0.0 110.934 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -94.08 162.75 13.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.805 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.39 93.42 0.85 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.182 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.401 ' CG1' ' HE2' ' A' ' 121' ' ' LYS . 6.6 m -83.23 128.31 38.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.13 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.437 ' CE1' ' HB3' ' A' ' 15' ' ' ARG . 0.2 OUTLIER -109.12 93.11 4.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.751 -179.91 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.583 HD22 HD11 ' A' ' 32' ' ' LEU . 1.3 mp -96.71 167.52 11.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.077 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.438 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -130.75 112.81 13.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.811 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.883 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -67.56 172.13 5.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.14 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -85.59 -66.05 0.94 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.024 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -97.96 170.86 8.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.881 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.01 -47.44 58.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.032 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.25 -38.4 90.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.139 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 30.4 t -61.75 -47.66 84.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.868 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.883 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -60.47 -41.2 93.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.224 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 51.9 mtp180 -70.08 -44.06 69.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.543 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.3 -34.32 77.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.054 179.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.403 ' O ' HD12 ' A' ' 172' ' ' ILE . 11.2 m95 -74.26 -50.86 17.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.834 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.653 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -56.23 -51.58 67.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.399 0.619 . . . . 0.0 110.491 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.94 -40.81 95.82 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.798 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.21 -41.09 77.55 Favored 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.355 -179.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.717 HG22 HD12 ' A' ' 176' ' ' ILE . 6.8 mt -62.65 -23.18 31.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.601 ' N ' HG11 ' A' ' 130' ' ' VAL . 54.2 tt0 -80.66 -30.52 36.55 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.315 179.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.57 -47.34 76.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.338 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . 0.568 ' HB3' HD21 ' A' ' 125' ' ' LEU . 2.0 mp0 -70.55 -39.37 74.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.998 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.717 HD12 HG22 ' A' ' 172' ' ' ILE . 84.5 mt -78.11 -9.95 12.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.195 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -86.6 26.88 6.12 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.448 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . 0.441 HG23 ' HG3' ' A' ' 126' ' ' LYS . 3.2 t . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.919 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.841 0.353 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.5 t -171.44 37.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.869 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -155.35 40.2 0.61 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.574 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 -101.82 -46.29 4.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.769 0.319 . . . . 0.0 110.871 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -81.99 169.15 17.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.891 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -134.68 95.96 15.37 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.98 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -67.65 154.8 72.38 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.513 2.142 . . . . 0.0 112.306 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.63 155.76 25.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.813 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.758 HG22 ' HA ' ' A' ' 33' ' ' SER . 74.6 p -144.35 138.12 27.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.968 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -136.72 121.62 2.41 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.435 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.548 HD22 ' HD3' ' A' ' 29' ' ' ARG . 31.0 mt -68.53 114.09 6.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.876 0.37 . . . . 0.0 110.921 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.455 HD22 ' HB2' ' A' ' 157' ' ' LEU . 0.2 OUTLIER -129.21 150.24 50.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.72 179.877 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -83.58 163.22 20.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.036 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 39.6 tp -130.95 126.63 36.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.636 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.473 ' HA ' ' CD2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.35 174.77 4.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.63 -179.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -165.16 59.12 0.12 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.954 0.406 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -141.51 30.98 2.17 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.532 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.11 108.62 18.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.875 0.369 . . . . 0.0 111.101 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 130.54 -98.12 0.4 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.507 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.3 p -168.08 161.4 12.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.795 0.331 . . . . 0.0 110.916 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.15 -49.18 0.9 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.474 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.57 125.72 27.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.929 0.395 . . . . 0.0 111.019 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -114.43 -28.0 3.17 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.605 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.18 15.63 60.15 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.75 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 57.0 104.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.788 0.328 . . . . 0.0 110.995 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.94 147.04 26.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.043 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.473 ' CD2' ' HA ' ' A' ' 15' ' ' ARG . 22.1 m95 -150.8 159.89 44.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.655 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -146.47 -175.02 4.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.994 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.548 ' HD3' HD22 ' A' ' 11' ' ' LEU . 0.3 OUTLIER -109.98 137.34 47.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 26.2 m -151.19 128.02 2.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.12 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.2 tp -81.98 127.23 32.85 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.424 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.468 HD12 HG13 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -94.16 92.78 7.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.104 -179.623 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.758 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.7 OUTLIER -73.15 89.22 1.49 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.579 179.462 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.711 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 4.6 tp -84.65 119.86 25.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.152 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -122.83 138.8 54.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.022 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -56.77 -23.2 41.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.462 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -89.55 -29.95 18.56 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.006 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.862 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -175.72 166.82 3.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.135 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.558 HD11 HG23 ' A' ' 172' ' ' ILE . 0.2 OUTLIER -103.56 152.93 21.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.752 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 88.3 m -158.21 132.64 8.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.772 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.635 ' O ' ' HB1' ' A' ' 120' ' ' ALA . 14.7 t -117.86 159.26 18.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.214 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.483 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -155.31 176.27 2.64 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.539 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.412 ' HD2' ' CB ' ' A' ' 42' ' ' SER . 84.7 Cg_endo -82.25 38.52 0.75 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.531 2.154 . . . . 0.0 112.841 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 48.89 28.68 2.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.116 0.484 . . . . 0.0 111.07 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -136.91 114.34 10.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.819 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 138.43 58.16 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.391 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -89.21 147.9 39.49 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.729 0.299 . . . . 0.0 110.851 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.12 93.51 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.6 2.2 . . . . 0.0 112.266 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 129.54 101.22 0.96 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.57 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -49.09 172.1 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.497 2.132 . . . . 0.0 112.305 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.458 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -179.37 -61.19 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.029 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.458 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 18.7 Cg_endo -59.88 82.84 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.452 2.101 . . . . 0.0 112.277 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.4 ' CB ' ' HD2' ' A' ' 54' ' ' PRO . 2.4 mt-10 -77.62 165.49 50.92 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.786 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.4 ' HD2' ' CB ' ' A' ' 53' ' ' GLU . 12.8 Cg_endo -56.28 142.88 87.31 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.643 2.228 . . . . 0.0 112.16 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -134.51 -166.64 1.84 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.097 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 62.95 88.05 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.815 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.52 169.89 13.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.876 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.11 122.17 25.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.894 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 98.8 56.56 1.01 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.431 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -130.29 155.26 46.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.786 0.327 . . . . 0.0 111.074 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -100.86 158.98 15.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.06 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -97.99 143.75 26.8 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.939 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.16 113.92 1.57 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.561 2.174 . . . . 0.0 112.231 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -79.89 72.82 2.53 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.448 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -80.04 132.75 36.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.844 0.354 . . . . 0.0 111.115 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.829 ' HB3' ' HD3' ' A' ' 67' ' ' PRO . . . -72.26 -59.53 2.62 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.251 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.829 ' HD3' ' HB3' ' A' ' 66' ' ' ALA . 67.2 Cg_endo -75.21 154.6 41.62 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.932 2.422 . . . . 0.0 112.425 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.13 80.55 1.26 Allowed 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.545 2.164 . . . . 0.0 112.375 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -92.79 150.16 20.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.927 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 60.74 99.82 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.832 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.09 171.74 12.05 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.421 2.081 . . . . 0.0 112.275 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.549 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.3 mt-10 64.56 70.79 0.48 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.353 0.597 . . . . 0.0 110.75 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 166.3 -33.02 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.652 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.4 tt -103.71 -30.25 10.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.006 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.647 ' C ' HD22 ' A' ' 75' ' ' LEU . 0.0 OUTLIER -74.62 -5.52 43.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.585 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.465 ' N ' HD13 ' A' ' 75' ' ' LEU . 0.8 OUTLIER -84.49 -49.15 8.89 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.855 0.36 . . . . 0.0 110.71 179.998 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -98.06 69.97 2.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.774 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -86.81 -40.29 15.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.897 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -98.15 31.45 2.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 20.7 t -126.89 -39.62 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.24 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.454 ' N ' ' HD2' ' A' ' 82' ' ' PRO . 0.4 OUTLIER -51.18 -56.75 17.55 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.368 -179.945 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 81' ' ' SER . 67.3 Cg_endo -75.72 59.26 5.61 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 122.933 2.422 . . . . 0.0 112.429 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER 57.02 171.93 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.067 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -173.61 138.9 0.69 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.829 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.75 101.1 0.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.976 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 60.35 100.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.817 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -133.71 -65.85 0.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.89 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -169.38 148.51 3.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.027 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -90.19 -43.3 5.03 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.531 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -178.42 -168.06 37.19 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.433 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.7 163.19 28.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.898 0.38 . . . . 0.0 110.983 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -167.28 103.67 0.53 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.831 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.2 p -99.19 145.86 9.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.072 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 171.12 -90.19 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.474 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 15.8 t90 60.94 83.3 0.15 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.821 0.343 . . . . 0.0 110.841 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 3.2 t0 60.68 52.35 4.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.84 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.4 t -149.55 74.28 9.64 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.94 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -55.39 169.93 0.96 Allowed 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.517 2.144 . . . . 0.0 112.161 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -66.82 -17.22 51.83 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.497 2.132 . . . . 0.0 112.492 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -82.53 109.78 17.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.166 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -140.81 164.84 33.68 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.874 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.31 -179.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.598 2.198 . . . . 0.0 112.24 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.505 ' N ' HD12 ' A' ' 103' ' ' LEU . 1.4 mp -120.05 161.43 20.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.901 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -161.04 134.73 6.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.852 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -119.68 42.05 2.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.834 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -110.39 94.89 20.09 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.844 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -49.72 92.29 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.508 2.138 . . . . 0.0 112.44 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -143.94 137.89 28.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.922 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -149.4 169.28 9.42 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.798 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.89 151.67 15.24 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.562 2.174 . . . . 0.0 112.322 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -144.18 -178.42 19.88 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.546 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.41 98.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.569 2.18 . . . . 0.0 112.357 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -132.72 71.0 78.98 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.988 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.45 101.68 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.633 2.222 . . . . 0.0 112.312 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.75 119.08 36.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.816 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -152.1 -69.36 0.16 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.937 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.618 HD13 ' O ' ' A' ' 119' ' ' GLU . 4.2 pp -108.46 149.66 28.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.01 -33.01 7.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.883 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.618 ' O ' HD13 ' A' ' 117' ' ' LEU . 4.7 tt0 -88.91 142.95 27.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.967 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.635 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -86.08 166.16 16.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.103 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -101.4 97.72 8.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.88 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -88.94 113.94 25.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.961 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.788 HG13 ' HB2' ' A' ' 148' ' ' ALA . 21.7 t -103.18 137.92 29.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.085 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.646 ' C ' HD22 ' A' ' 125' ' ' LEU . 0.3 OUTLIER -76.27 159.79 30.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.868 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.862 HD23 ' HA ' ' A' ' 38' ' ' ALA . 4.2 mm? -123.6 34.36 5.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.974 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.29 34.84 1.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.964 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 3.3 ptp 178.55 -37.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.0 -177.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.324 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.415 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.2 OUTLIER -159.23 124.36 4.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.461 179.918 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.699 HG12 HD12 ' A' ' 176' ' ' ILE . 2.9 p -101.27 159.95 3.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.318 0.58 . . . . 0.0 111.497 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.519 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -161.45 156.13 23.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.994 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.65 139.72 53.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.772 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 -157.48 -173.0 4.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.793 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 3.8 p -118.24 176.26 5.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.022 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.45 HG23 ' HD3' ' A' ' 136' ' ' PRO . 0.1 OUTLIER -98.9 -52.51 0.2 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.303 -179.689 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . 0.45 ' HD3' HG23 ' A' ' 135' ' ' THR . 1.8 Cg_endo -84.95 12.49 3.06 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 123.015 2.477 . . . . 0.0 112.722 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . 0.423 HG23 ' C ' ' A' ' 136' ' ' PRO . 1.4 p 68.16 30.35 5.79 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.933 0.397 . . . . 0.0 110.38 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 52.3 p-10 -108.43 146.66 34.1 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.03 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -63.02 78.25 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.531 2.154 . . . . 0.0 112.115 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -165.51 107.77 0.76 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.805 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.511 ' CB ' ' HB3' ' A' ' 165' ' ' ALA . 82.8 Cg_exo -47.59 98.23 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.56 2.173 . . . . 0.0 112.388 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 2.1 mtt85 -146.25 31.67 1.01 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.943 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -165.3 91.63 0.53 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.057 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.855 ' CD2' ' HB2' ' A' ' 169' ' ' ALA . 1.2 mt -94.23 116.14 28.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.753 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -108.98 130.29 55.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.87 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.445 HG12 HG23 ' A' ' 130' ' ' VAL . 35.6 mt -132.91 120.72 42.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.097 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 35.8 t -109.78 124.27 50.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.777 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.788 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -108.53 147.51 31.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.21 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.47 30.74 2.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.179 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -112.09 42.75 1.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.404 179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.68 25.28 2.17 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.955 -0.641 . . . . 0.0 112.359 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.56 60.55 2.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.068 0.461 . . . . 0.0 110.923 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.523 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 1.5 m-20 -93.31 148.38 22.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.861 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -155.64 90.41 1.24 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.092 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 27.2 m -88.94 131.2 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.21 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -118.0 96.29 5.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.68 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.455 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.7 OUTLIER -103.28 167.06 10.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.041 -179.712 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.455 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 69.2 ttt180 -132.8 101.16 5.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.719 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.517 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -58.85 173.49 0.43 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.158 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.06 -33.27 10.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.935 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.03 -170.01 1.78 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.822 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -108.21 -56.66 2.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.71 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -64.39 -29.91 70.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.872 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 3.4 m -65.25 -47.48 76.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.504 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.572 ' HA ' HD11 ' A' ' 144' ' ' LEU . . . -61.54 -46.05 91.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.026 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -69.64 -37.91 76.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.518 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 88.5 p -70.01 -34.21 73.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.167 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.711 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 6.9 m95 -73.06 -48.88 32.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.865 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.855 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -57.3 -51.82 67.82 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.359 0.599 . . . . 0.0 110.486 179.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.82 -40.87 93.62 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.748 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.96 76.39 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.049 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.564 HG22 ' CD1' ' A' ' 176' ' ' ILE . 9.5 mt -61.62 -22.83 29.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.539 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -71.11 -55.53 8.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.477 179.239 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . 0.713 ' HA ' HG22 ' A' ' 178' ' ' THR . . . -52.73 -37.74 59.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.119 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.43 -30.46 57.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.311 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.699 HD12 HG12 ' A' ' 130' ' ' VAL . 19.4 mt -71.33 -25.91 25.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.913 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 111.13 37.35 1.67 Allowed Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.788 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . 0.713 HG22 ' HA ' ' A' ' 174' ' ' ALA . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.902 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.821 0.343 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.6 t -130.09 166.43 20.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.815 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -156.83 124.81 1.49 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.515 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.02 178.99 5.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.826 0.346 . . . . 0.0 110.85 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 10.9 mmt-85 -70.62 155.05 41.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.017 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -104.69 88.92 2.46 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.099 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -68.74 152.21 74.23 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.502 2.135 . . . . 0.0 112.452 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.536 ' NH2' ' HB1' ' A' ' 171' ' ' ALA . 34.3 ttp180 -97.56 143.42 28.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.977 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.0 p -141.44 154.6 45.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.938 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -159.6 135.79 4.3 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.535 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.506 HD22 ' HB1' ' A' ' 44' ' ' ALA . 66.4 mt -66.56 105.3 1.47 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.806 0.336 . . . . 0.0 110.989 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.575 HD13 HD22 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -116.26 152.34 34.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.819 179.92 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.425 ' HB3' ' CE3' ' A' ' 27' ' ' TRP . 4.5 tt0 -78.93 170.11 17.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.878 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.407 ' C ' ' CE3' ' A' ' 27' ' ' TRP . 39.7 tp -145.33 120.81 10.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.74 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.467 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.2 OUTLIER -69.49 157.6 36.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.453 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -169.71 79.7 0.11 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.023 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -175.49 33.4 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.624 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 54.12 99.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.834 0.349 . . . . 0.0 111.227 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.01 87.87 0.38 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.659 -0.782 . . . . 0.0 112.556 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.1 m -112.72 -65.2 1.21 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.828 0.347 . . . . 0.0 110.95 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -174.19 -53.13 0.05 OUTLIER Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.455 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -151.16 129.24 11.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.802 0.334 . . . . 0.0 111.149 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -177.87 -68.47 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.459 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 163.42 74.12 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.428 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.33 131.92 52.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.784 0.326 . . . . 0.0 110.808 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 mtm180 -113.68 68.91 0.69 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.921 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.467 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 21.7 m95 -56.69 -178.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.776 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.56 175.88 5.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.88 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -105.62 127.03 52.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.958 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 34.4 m -141.46 130.26 23.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.109 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.7 tp -73.5 124.9 26.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.751 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.82 HD12 HG13 ' A' ' 41' ' ' VAL . 1.9 tp -92.39 125.38 37.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.972 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.14 87.89 3.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.78 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.728 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 4.8 tp -84.09 123.14 29.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.015 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -134.28 139.77 45.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.016 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.36 -23.53 49.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.103 0.478 . . . . 0.0 111.278 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -83.77 -31.17 26.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.89 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.685 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -174.62 169.1 3.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.262 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.521 ' HG ' HD12 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -112.76 106.58 14.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.723 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 28.0 m -115.7 132.04 56.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.997 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.82 HG13 HD12 ' A' ' 32' ' ' LEU . 17.6 t -106.24 160.15 5.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.921 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.479 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -165.44 167.17 9.62 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.764 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.63 148.45 65.93 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.571 2.181 . . . . 0.0 112.267 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.506 ' HB1' HD22 ' A' ' 11' ' ' LEU . . . -96.4 43.3 1.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.004 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -149.71 31.64 0.71 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.949 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 94.77 -160.88 23.52 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.638 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -112.53 161.67 25.22 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.694 0.283 . . . . 0.0 110.9 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -50.15 178.54 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.759 2.306 . . . . 0.0 112.234 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -105.05 90.81 0.72 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.633 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.76 -170.95 0.67 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.665 2.243 . . . . 0.0 112.179 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 58.72 88.74 0.12 Allowed Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.989 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -51.49 117.83 3.83 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.537 2.158 . . . . 0.0 112.395 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -98.71 98.59 6.3 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.864 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -67.86 84.64 0.41 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.4 2.067 . . . . 0.0 112.323 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.747 ' HB1' ' O ' ' A' ' 109' ' ' SER . . . -79.8 158.59 26.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.016 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -105.43 175.59 5.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.92 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.451 HD12 ' H ' ' A' ' 57' ' ' LEU . 3.6 mp -90.54 166.08 13.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.919 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -143.69 85.21 1.82 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.98 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 121.23 125.57 3.2 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.425 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -112.63 150.6 31.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.821 0.343 . . . . 0.0 111.066 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 60.59 169.5 0.09 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.06 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 54.96 67.66 3.07 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.945 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.47 -173.44 0.02 OUTLIER 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.504 2.136 . . . . 0.0 112.238 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.95 -63.76 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.563 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -121.79 95.04 4.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.788 0.328 . . . . 0.0 111.103 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.814 ' HB3' ' HD3' ' A' ' 67' ' ' PRO . . . -73.21 -59.53 2.07 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.261 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.814 ' HD3' ' HB3' ' A' ' 66' ' ' ALA . 72.2 Cg_endo -75.91 162.52 34.69 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 123.002 2.468 . . . . 0.0 112.504 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -56.7 -163.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.666 2.244 . . . . 0.0 112.284 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -88.1 -176.27 5.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.919 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.1 mp -128.45 108.52 19.19 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.016 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.537 ' HB2' HD21 ' A' ' 75' ' ' LEU . 56.9 Cg_endo -70.38 -165.78 0.18 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.509 2.139 . . . . 0.0 112.248 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.712 ' HA ' HD11 ' A' ' 75' ' ' LEU . 2.3 mt-10 68.79 73.55 0.27 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.382 0.61 . . . . 0.0 110.714 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.571 ' C ' HD12 ' A' ' 74' ' ' LEU . . . 170.26 -37.89 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.552 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.571 HD12 ' C ' ' A' ' 73' ' ' ALA . 5.9 mp -112.23 -17.66 12.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.171 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.712 HD11 ' HA ' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -95.47 -15.01 23.24 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.617 -179.862 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.764 HD22 ' O ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -98.39 0.1 44.7 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.755 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.437 ' N ' HD13 ' A' ' 76' ' ' LEU . 18.4 pt20 -146.93 45.25 1.18 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.827 0.346 . . . . 0.0 111.087 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.17 -35.34 2.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.268 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -111.64 40.6 2.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.933 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 25.9 t -126.1 -48.36 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.148 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.4 m -64.69 162.91 31.82 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.841 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -79.17 49.94 3.33 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.101 2.534 . . . . 0.0 112.558 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 175.7 76.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.904 0.383 . . . . 0.0 110.589 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -109.11 150.73 27.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.908 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 168.29 1.29 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.998 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 16.9 p-10 -173.82 100.64 0.11 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.963 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -89.94 85.78 6.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.883 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -149.39 135.36 18.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.086 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 105.52 110.5 3.51 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.506 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -71.42 -81.72 0.29 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.614 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.98 146.79 37.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.868 0.366 . . . . 0.0 110.943 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -149.31 103.26 3.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.828 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.65 151.44 10.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.065 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 121.97 34.08 0.87 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.635 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 55.79 85.51 0.07 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.779 0.323 . . . . 0.0 111.013 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -170.4 45.39 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.809 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.3 t -129.7 80.51 71.48 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.871 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_exo -52.01 118.17 4.27 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.575 2.184 . . . . 0.0 112.232 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.65 -25.8 40.08 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.325 2.017 . . . . 0.0 112.321 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.22 147.26 36.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.096 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 95.9 p -121.35 92.35 48.57 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.888 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -50.43 102.88 0.06 OUTLIER 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.649 2.232 . . . . 0.0 112.35 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.2 mt 59.84 -179.08 0.09 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.914 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -164.24 79.76 0.39 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.785 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 57.2 mtt180 -139.59 148.89 43.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.922 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.427 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 0.0 OUTLIER -71.11 -61.62 2.21 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.131 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' A' ' 106' ' ' GLN . 35.8 Cg_endo -65.21 154.24 74.46 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.454 2.103 . . . . 0.0 112.385 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 64.4 p -121.62 149.72 42.76 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.838 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.747 ' O ' ' HB1' ' A' ' 55' ' ' ALA . 0.4 OUTLIER -74.28 -59.02 1.77 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.186 -179.994 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.411 ' HD3' ' CB ' ' A' ' 109' ' ' SER . 70.1 Cg_endo -75.93 163.56 33.1 Favored 'Trans proline' 0 N--CA 1.465 -0.177 0 C-N-CA 122.819 2.346 . . . . 0.0 112.493 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -161.18 62.66 0.28 Allowed Glycine 0 CA--C 1.519 0.297 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.449 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.01 147.15 27.25 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.538 2.158 . . . . 0.0 112.46 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -135.82 60.22 34.42 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.875 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.03 64.63 2.56 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.448 2.099 . . . . 0.0 112.341 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 mtt180 -76.34 157.01 32.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.846 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -170.84 -56.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.869 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 24.9 tp -139.98 62.98 1.49 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.826 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 74.6 m -65.46 -33.46 76.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.917 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -95.93 139.88 31.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.892 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.79 -170.14 0.4 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.085 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.06 78.03 1.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.861 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 -71.46 146.75 48.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.057 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.4 t -149.45 113.29 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.067 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.18 147.73 52.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.064 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' A' ' 176' ' ' ILE . 3.0 mm? -98.31 -176.95 3.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.741 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 67.62 45.41 1.5 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.989 0.423 . . . . 0.0 110.95 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.578 ' HG2' ' HB3' ' A' ' 149' ' ' ALA . 0.2 OUTLIER 178.45 -37.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.768 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.696 ' HB1' ' O ' ' A' ' 147' ' ' CYS . . . -68.09 -176.57 0.72 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.173 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.473 ' HA ' HG21 ' A' ' 176' ' ' ILE . 53.3 p90 -162.23 115.15 1.74 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.807 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.563 HG11 ' N ' ' A' ' 173' ' ' GLN . 1.6 p -78.78 158.92 4.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.274 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.473 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.9 OUTLIER -164.59 119.04 1.38 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.672 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 17.0 ptt-85 -94.05 86.35 4.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.866 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 10.0 mtt85 -69.92 178.12 2.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.869 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 19.0 p -127.63 153.38 46.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.935 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.41 HG23 ' CD1' ' A' ' 143' ' ' TYR . 13.3 p -104.41 158.21 32.45 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.829 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . 0.409 ' HD2' ' HB ' ' A' ' 135' ' ' THR . 36.3 Cg_endo -65.42 -17.53 57.9 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.506 2.138 . . . . 0.0 112.446 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.57 32.82 4.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.045 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -57.62 109.33 1.7 Allowed Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.022 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -78.89 -22.2 9.0 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.454 2.102 . . . . 0.0 112.544 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.401 ' N ' ' CD ' ' A' ' 141' ' ' PRO . 0.3 OUTLIER -179.62 -52.48 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.198 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.107 179.875 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' A' ' 140' ' ' GLU . 45.3 Cg_exo -56.65 -164.57 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.462 2.108 . . . . 0.0 112.237 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.56 140.32 18.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.969 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.41 ' CD1' HG23 ' A' ' 135' ' ' THR . 0.1 OUTLIER -62.05 98.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.758 179.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.658 HD12 ' HB2' ' A' ' 159' ' ' ALA . 2.3 mt -84.94 86.15 7.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.638 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.41 131.41 53.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.902 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.868 HD13 HG21 ' A' ' 172' ' ' ILE . 28.8 mt -126.87 137.38 58.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.082 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.696 ' O ' ' HB1' ' A' ' 128' ' ' ALA . 0.8 OUTLIER -107.17 158.9 16.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.83 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.917 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -136.86 144.07 43.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.204 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.578 ' HB3' ' HG2' ' A' ' 127' ' ' MET . . . -95.73 31.16 2.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.234 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -116.44 44.88 1.9 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.457 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.74 23.22 3.12 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.432 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 59.62 62.0 1.84 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.034 0.445 . . . . 0.0 110.798 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.917 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 5.0 m-20 -94.76 156.42 16.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.814 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.82 93.64 0.82 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.152 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.2 m -83.19 130.13 36.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.162 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -106.56 89.56 3.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.837 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.3 mt -105.39 155.98 18.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.046 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.439 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 13.6 ttm180 -127.01 112.37 15.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.792 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.852 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -57.88 173.51 0.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.124 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.91 -31.11 11.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.99 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.92 -179.59 3.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -87.63 -59.16 2.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.875 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -62.24 -33.25 74.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.128 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.89 -44.86 84.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.753 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.852 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -64.37 -43.56 94.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.022 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.78 -41.07 75.61 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.158 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 60.5 p -65.32 -40.67 94.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.728 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 8.7 m95 -66.52 -55.59 14.83 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.505 179.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.47 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -46.02 -64.99 0.61 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.19 0.519 . . . . 0.0 110.897 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -49.7 -36.77 26.13 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.105 179.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . 0.536 ' HB1' ' NH2' ' A' ' 8' ' ' ARG . . . -69.0 -40.35 78.77 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.968 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.868 HG21 HD13 ' A' ' 146' ' ' ILE . 30.6 mm -59.68 -24.28 28.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 177.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.563 ' N ' HG11 ' A' ' 130' ' ' VAL . 2.7 tt0 -75.71 -44.64 40.98 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.779 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . 0.743 ' HA ' HG22 ' A' ' 178' ' ' THR . . . -56.76 -48.69 77.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.169 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -71.21 -32.06 68.36 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.067 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.721 ' HA ' HD12 ' A' ' 125' ' ' LEU . 7.0 mt -66.04 -28.85 44.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.619 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 116.18 43.25 0.67 Allowed Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.632 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . 0.743 HG22 ' HA ' ' A' ' 174' ' ' ALA . 1.7 t . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.259 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.791 0.329 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.2 m -168.42 145.06 3.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.918 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -165.03 172.96 40.84 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.487 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.2 ttt-85 -116.22 91.27 3.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.865 0.364 . . . . 0.0 110.936 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.91 94.29 0.26 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.819 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -147.38 99.36 3.89 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.033 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -56.71 149.24 60.54 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.519 2.146 . . . . 0.0 112.395 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.96 121.31 42.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.423 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.42 HG22 ' HA ' ' A' ' 33' ' ' SER . 9.0 p -132.25 139.56 48.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.014 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.82 143.35 12.15 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.485 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' A' ' 11' ' ' LEU . 6.7 mt -69.52 106.98 3.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.764 0.316 . . . . 0.0 110.891 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.044 HD21 HD12 ' A' ' 144' ' ' LEU . 0.2 OUTLIER -121.95 144.22 49.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.649 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.431 ' O ' HD23 ' A' ' 157' ' ' LEU . 18.4 mt-10 -84.02 155.82 22.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.948 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tp -136.09 137.78 41.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.664 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.492 ' HB3' ' CE2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.61 -164.88 0.07 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.679 -179.814 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -174.59 40.86 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.91 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.13 107.04 2.07 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.53 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -88.48 120.22 29.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.822 0.344 . . . . 0.0 111.12 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 105.35 -174.83 21.5 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.56 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.14 131.05 42.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.791 0.329 . . . . 0.0 110.926 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 62.66 -164.39 26.35 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.409 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.95 97.08 8.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.847 0.356 . . . . 0.0 111.108 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -122.5 69.61 0.43 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.396 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.33 62.74 2.51 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.493 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.9 159.06 30.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.831 0.348 . . . . 0.0 110.98 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.9 mtm180 -135.69 77.74 1.68 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.804 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.492 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 26.9 m95 -53.33 111.59 0.73 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.139 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.52 ' HG3' HD11 ' A' ' 70' ' ' LEU . 1.8 tt0 -108.6 146.86 32.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.806 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.7 ttt85 -72.9 136.07 45.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.008 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 42' ' ' SER . 35.1 m -141.17 169.95 14.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.109 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 tp -120.63 117.25 27.05 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.641 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.632 ' HG ' HG22 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -87.93 110.49 20.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.947 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.42 ' HA ' HG22 ' A' ' 9' ' ' THR . 7.8 t -89.85 79.86 6.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.666 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.99 HD12 HD23 ' A' ' 39' ' ' LEU . 1.1 tp -77.11 99.83 5.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.046 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.68 147.54 27.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.935 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -61.9 -16.22 48.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.444 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.49 -27.28 18.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.861 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.869 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -176.78 -179.74 1.0 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.974 0.416 . . . . 0.0 111.255 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.99 HD23 HD12 ' A' ' 34' ' ' LEU . 3.1 tm? -117.29 114.29 23.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.859 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 58.4 m -127.72 134.77 49.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.986 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.632 HG22 ' HG ' ' A' ' 32' ' ' LEU . 14.6 t -111.7 159.01 11.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.3 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.482 ' N ' HG12 ' A' ' 41' ' ' VAL . 9.9 p -148.04 160.64 37.05 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.372 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.447 ' HD3' HD23 ' A' ' 117' ' ' LEU . 72.2 Cg_endo -77.11 47.43 2.23 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.496 2.131 . . . . 0.0 112.871 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 43.68 30.39 0.36 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.018 0.437 . . . . 0.0 111.549 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.9 121.45 15.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.924 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -84.54 -91.78 0.77 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.461 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -72.78 111.13 10.06 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.485 0.184 . . . . 0.0 110.841 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -68.78 102.19 0.85 Allowed 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.43 2.087 . . . . 0.0 112.273 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.01 69.23 0.81 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.423 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.26 105.41 1.56 Allowed 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.678 2.252 . . . . 0.0 112.252 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.427 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 0.1 OUTLIER -72.3 -56.71 4.04 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.966 179.92 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 72.2 Cg_endo -75.03 160.84 39.59 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.531 2.154 . . . . 0.0 112.293 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.414 ' OE1' ' HB2' ' A' ' 55' ' ' ALA . 0.2 OUTLIER -109.04 151.86 42.16 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.003 -179.989 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.91 115.48 4.27 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.541 2.161 . . . . 0.0 112.203 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.414 ' HB2' ' OE1' ' A' ' 53' ' ' GLU . . . -149.94 163.88 36.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.169 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -80.23 -25.71 39.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.995 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -95.75 21.83 7.99 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.172 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -95.67 -31.29 13.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.769 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.12 165.31 35.75 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.518 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -83.07 155.57 23.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.857 0.361 . . . . 0.0 111.078 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -164.71 108.38 0.9 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.17 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.88 84.43 0.2 Allowed Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.984 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.42 138.62 56.51 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.571 2.18 . . . . 0.0 112.368 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 132.27 138.78 4.19 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.563 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 59.73 93.1 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.827 0.346 . . . . 0.0 111.189 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.92 156.17 27.4 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.073 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.01 146.2 30.53 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.635 2.224 . . . . 0.0 112.29 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.85 62.62 3.14 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.381 2.054 . . . . 0.0 112.378 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -87.26 137.76 32.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.89 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.52 HD11 ' HG3' ' A' ' 28' ' ' GLN . 0.6 OUTLIER -110.42 88.57 7.63 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.859 179.981 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.9 -178.03 1.85 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.537 2.158 . . . . 0.0 112.349 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.549 ' HA ' HD11 ' A' ' 75' ' ' LEU . 2.4 mt-10 65.18 71.48 0.45 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.414 0.625 . . . . 0.0 110.712 -179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.52 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 169.51 -48.43 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.603 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -90.42 -32.4 16.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.61 179.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.679 HD12 ' N ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -67.72 -14.11 62.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.424 179.923 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.679 ' N ' HD12 ' A' ' 75' ' ' LEU . 0.9 OUTLIER -89.2 -42.69 11.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.867 0.365 . . . . 0.0 110.894 -179.97 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -72.77 84.97 1.21 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.951 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.55 -48.27 0.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.821 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.437 ' HB2' ' CD1' ' A' ' 84' ' ' PHE . 2.4 pt-20 -112.15 31.82 5.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.885 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.2 t -141.27 -47.06 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.224 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.417 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.4 OUTLIER -66.92 -54.58 20.26 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.182 179.994 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 81' ' ' SER . 86.9 Cg_endo -82.96 47.55 2.47 Favored 'Trans proline' 0 N--CA 1.464 -0.214 0 C-N-CA 123.123 2.549 . . . . 0.0 112.638 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 60.87 152.76 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.049 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.437 ' CD1' ' HB2' ' A' ' 79' ' ' GLU . 4.9 t80 -178.45 77.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.841 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.18 161.42 27.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.908 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -141.6 168.34 20.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.884 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.7 m -128.72 153.52 47.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -78.22 145.01 35.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.142 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.48 147.04 4.79 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.483 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 156.18 43.83 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.559 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.0 p -69.34 77.91 0.38 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.815 0.341 . . . . 0.0 111.015 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.37 21.68 5.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.113 0.482 . . . . 0.0 111.239 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.0 p -59.71 128.31 20.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.094 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 167.6 42.62 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.497 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -151.79 75.03 1.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.847 0.356 . . . . 0.0 110.894 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -108.92 39.62 1.99 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.972 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -153.21 90.42 3.5 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.886 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -68.5 111.07 2.44 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.647 2.231 . . . . 0.0 112.295 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -78.92 -27.66 4.52 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.437 2.091 . . . . 0.0 112.47 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -103.81 176.28 5.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.249 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 8.7 t -167.58 78.41 0.92 Allowed Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.667 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -68.78 173.15 10.49 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.648 2.232 . . . . 0.0 112.41 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.2 mp -94.93 -23.04 17.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.084 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 67.83 157.37 0.13 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.892 0.377 . . . . 0.0 110.937 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 58.6 mtt-85 -90.18 162.18 15.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.963 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.26 77.35 0.4 Allowed Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.905 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.91 -45.25 1.01 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.481 2.121 . . . . 0.0 112.32 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.69 -68.43 0.38 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.9 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.32 159.62 0.11 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.952 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -69.29 139.81 42.82 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.622 2.214 . . . . 0.0 112.294 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -145.62 -155.24 6.41 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.508 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.26 151.1 18.11 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.574 2.183 . . . . 0.0 112.309 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.17 120.59 71.46 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.801 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.37 130.06 36.64 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.437 2.091 . . . . 0.0 112.358 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 14.6 mtt180 -163.31 33.93 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.889 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -79.74 140.75 36.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.891 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.447 HD23 ' HD3' ' A' ' 43' ' ' PRO . 15.7 tp 67.79 -69.63 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.924 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 67.27 -71.71 0.1 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.006 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.25 135.18 54.1 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.831 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.66 157.16 32.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.131 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 17.1 mttm -101.8 90.66 4.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.928 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 19.7 m80 -84.98 138.91 32.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 19.2 t -138.45 116.88 13.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.074 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 92.5 p -70.8 125.15 26.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.905 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.869 HD23 ' HA ' ' A' ' 38' ' ' ALA . 4.1 mm? -66.52 -179.48 0.84 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.917 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 60.48 35.77 20.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.859 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.41 ' SD ' ' HB3' ' A' ' 149' ' ' ALA . 2.5 mmt -164.74 -44.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.89 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.64 -165.54 0.06 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.256 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.648 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.1 OUTLIER -169.86 127.07 0.87 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.503 179.92 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.585 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.5 p -99.84 158.88 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.361 0.6 . . . . 0.0 111.646 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.481 ' N ' HG22 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -166.5 133.0 2.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.677 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.444 ' HD3' ' HB3' ' A' ' 169' ' ' ALA . 39.4 ptt85 -102.96 96.05 6.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.846 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -114.48 176.79 4.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.914 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . 0.422 ' C ' HG22 ' A' ' 135' ' ' THR . 23.3 p -113.83 -164.34 0.92 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.762 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.574 HG23 ' CD ' ' A' ' 136' ' ' PRO . 0.5 OUTLIER -164.38 -62.44 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.013 179.784 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . 0.574 ' CD ' HG23 ' A' ' 135' ' ' THR . 20.4 Cg_endo -62.68 -72.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.127 1.885 . . . . 0.0 112.265 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 7.6 t -159.56 28.32 0.19 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.904 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 27.5 t70 51.4 65.6 6.34 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.163 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.77 -60.78 0.22 Allowed 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.464 2.11 . . . . 0.0 112.241 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.424 ' CB ' ' HD3' ' A' ' 141' ' ' PRO . 0.5 OUTLIER 177.49 -53.18 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.957 179.925 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.424 ' HD3' ' CB ' ' A' ' 140' ' ' GLU . 45.0 Cg_exo -56.65 -27.04 68.23 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.493 2.128 . . . . 0.0 112.318 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.8 mtt85 61.41 163.63 0.08 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.948 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.452 ' CZ ' ' CD ' ' A' ' 158' ' ' ARG . 15.0 m-85 -110.28 123.05 49.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.904 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 1.044 HD12 HD21 ' A' ' 12' ' ' LEU . 80.8 mt -83.58 132.63 34.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.777 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -133.68 125.36 28.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.789 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.493 HD11 HD13 ' A' ' 172' ' ' ILE . 22.8 mt -130.46 117.99 41.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.187 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 35.5 m -100.3 143.55 30.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.829 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.817 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -112.77 149.01 33.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.308 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.41 ' HB3' ' SD ' ' A' ' 127' ' ' MET . . . -95.92 30.58 2.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.255 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -120.98 48.15 1.69 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.074 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.35 19.11 3.58 Favored Glycine 0 N--CA 1.451 -0.332 0 CA-C-N 115.615 -0.72 . . . . 0.0 112.173 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.408 ' HA ' ' NE2' ' A' ' 152' ' ' GLN . 4.8 mm-40 58.45 61.14 2.34 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 121.123 0.487 . . . . 0.0 111.063 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.817 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 2.9 m-20 -87.6 161.97 17.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.835 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -162.61 93.7 0.84 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.1 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 5.0 m -85.71 124.57 40.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.029 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -105.98 106.06 16.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.765 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.431 HD23 ' O ' ' A' ' 13' ' ' GLU . 1.8 mt -113.76 164.6 13.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.076 -179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.452 ' CD ' ' CZ ' ' A' ' 143' ' ' TYR . 1.3 tpt180 -130.96 97.29 4.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.694 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.817 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.52 174.15 0.11 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.413 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -88.85 -67.21 0.85 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.003 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.39 173.84 7.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.105 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.52 -34.01 25.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.923 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -74.2 -46.33 42.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.936 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.5 -39.97 95.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.651 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.817 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -66.69 -42.34 86.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.997 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.7 mtt180 -70.7 -40.68 72.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.55 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 41.9 p -67.98 -33.05 73.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.145 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.596 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.7 m95 -73.0 -50.86 20.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.875 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.737 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -56.45 -50.06 72.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.306 0.574 . . . . 0.0 110.467 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.26 -42.2 95.32 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.647 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.04 -40.53 78.54 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.964 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.756 HG22 HD12 ' A' ' 176' ' ' ILE . 31.8 mt -60.89 -24.51 32.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.585 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.1 OUTLIER -81.77 -28.78 33.09 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.219 179.161 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.76 -50.54 66.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.128 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -67.29 -41.54 85.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.856 178.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.756 HD12 HG22 ' A' ' 172' ' ' ILE . 83.1 mt -77.39 -5.59 7.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.224 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -86.55 25.56 7.18 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.541 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 5.4 t . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.889 -179.984 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.736 0.303 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.3 m -144.4 -177.43 5.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.903 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 156.98 -78.84 0.19 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.459 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.44 28.93 18.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.701 0.286 . . . . 0.0 110.949 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.93 130.47 55.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.948 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -160.26 139.05 7.74 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.045 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -68.86 141.26 48.5 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.52 2.146 . . . . 0.0 112.36 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.764 ' HB3' HD23 ' A' ' 34' ' ' LEU . 5.4 ttm105 -70.59 133.98 47.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.874 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.462 HG22 ' HA ' ' A' ' 33' ' ' SER . 75.2 p -135.17 138.86 44.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.005 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -143.51 126.88 2.9 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.38 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.623 HD13 HH11 ' A' ' 29' ' ' ARG . 64.4 mt -68.85 99.38 1.03 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.823 0.344 . . . . 0.0 110.937 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.607 HD22 ' CB ' ' A' ' 157' ' ' LEU . 0.2 OUTLIER -106.03 151.17 24.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.788 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -88.35 134.79 33.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.513 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 20.6 tp -108.39 139.17 43.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.495 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.539 ' HB3' ' CZ2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -69.46 -167.22 0.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.746 0.307 . . . . 0.0 110.918 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -170.93 82.33 0.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.895 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -149.53 -109.95 0.52 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.528 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 60.38 31.62 20.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.74 0.305 . . . . 0.0 111.137 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -95.64 -106.91 2.19 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.516 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.32 -55.2 2.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.81 0.338 . . . . 0.0 110.934 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -145.71 165.93 27.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.422 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.01 116.49 14.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.845 0.355 . . . . 0.0 111.134 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 173.07 79.8 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.434 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.53 69.43 0.66 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.44 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -88.57 158.93 18.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.391 . . . . 0.0 110.942 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -123.14 60.44 1.05 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.722 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.539 ' CZ2' ' HB3' ' A' ' 15' ' ' ARG . 33.5 m95 -57.56 98.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.075 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -89.65 -176.69 5.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.686 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.623 HH11 HD13 ' A' ' 11' ' ' LEU . 0.7 OUTLIER -106.41 130.08 54.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.851 0.358 . . . . 0.0 110.911 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 33.8 m -137.11 134.14 47.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.264 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 10.5 tp -78.86 128.12 32.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.7 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.658 HD12 HG13 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -99.38 123.6 43.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.045 -179.907 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.462 ' HA ' HG22 ' A' ' 9' ' ' THR . 1.1 t -97.51 89.87 4.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.708 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.774 HD22 ' CZ3' ' A' ' 168' ' ' TRP . 2.5 tp -93.56 95.11 9.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.04 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -105.46 153.11 22.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.915 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -64.44 -14.04 54.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.409 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -96.13 -21.94 17.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.094 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.777 ' HA ' HD23 ' A' ' 125' ' ' LEU . . . -178.15 174.2 1.38 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.844 0.354 . . . . 0.0 111.134 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.601 HD13 HD12 ' A' ' 34' ' ' LEU . 21.6 tp -131.21 97.5 4.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.773 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 51.8 m -111.53 137.44 49.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.946 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.658 HG13 HD12 ' A' ' 32' ' ' LEU . 15.6 t -100.25 159.55 3.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.047 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.482 ' N ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -170.05 149.71 3.43 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.814 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.652 ' HD3' HD12 ' A' ' 117' ' ' LEU . 52.1 Cg_exo -52.89 153.06 16.0 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.511 2.141 . . . . 0.0 112.13 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -93.05 49.34 1.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.122 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -141.91 155.93 45.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.953 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 153.77 48.34 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.499 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.87 114.36 61.78 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.502 0.192 . . . . 0.0 110.945 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -72.32 173.74 12.61 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.387 2.058 . . . . 0.0 112.325 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 165.25 -102.13 0.19 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.554 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -74.68 112.1 3.47 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.555 2.17 . . . . 0.0 112.345 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.454 ' N ' ' HD2' ' A' ' 52' ' ' PRO . 1.0 OUTLIER -78.34 -48.39 1.92 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.399 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 51' ' ' GLU . 96.5 Cg_endo -79.74 118.01 3.74 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.293 1.995 . . . . 0.0 112.436 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -106.68 100.53 31.41 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.943 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.8 179.04 2.91 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.424 2.083 . . . . 0.0 112.301 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -77.18 172.89 12.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.099 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -107.58 -74.87 0.64 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.888 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 61.4 31.74 19.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.803 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -157.58 137.5 12.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -129.77 28.68 3.91 Favored Glycine 0 C--N 1.331 0.258 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.448 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.17 172.54 8.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.69 0.281 . . . . 0.0 111.126 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -148.55 125.33 11.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.042 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -90.04 133.32 33.88 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.888 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.08 170.93 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.429 2.086 . . . . 0.0 112.258 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -177.9 50.08 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.563 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 59.68 38.01 22.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.784 0.326 . . . . 0.0 111.08 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 60.99 66.2 1.76 Allowed Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.046 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.82 170.6 17.45 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.536 2.157 . . . . 0.0 112.367 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.52 129.57 17.0 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.524 2.149 . . . . 0.0 112.297 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -109.85 154.04 23.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.954 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -83.57 114.61 54.69 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.886 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.66 -175.46 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.42 2.08 . . . . 0.0 112.362 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.3 mt-10 64.06 70.55 0.5 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.422 0.63 . . . . 0.0 110.647 -179.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 167.36 -44.92 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.563 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.9 mp -94.34 -37.18 11.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.742 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.689 HD12 ' N ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -65.62 -15.15 62.47 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.409 179.978 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.689 ' N ' HD12 ' A' ' 75' ' ' LEU . 0.3 OUTLIER -82.07 -28.96 32.09 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.859 179.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -138.94 97.5 3.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.858 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.92 -23.98 14.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.182 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -96.34 31.57 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.194 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.531 ' O ' HG12 ' A' ' 80' ' ' VAL . 37.7 t -124.19 -3.67 6.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.661 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.478 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -76.78 -50.03 2.54 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-O 120.938 0.399 . . . . 0.0 111.119 179.974 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 81' ' ' SER . 47.5 Cg_endo -93.6 -141.57 0.02 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 123.615 2.877 . . . . 0.0 111.521 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -100.79 86.61 3.13 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.818 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -152.3 130.98 12.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.83 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -155.73 -176.1 5.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.896 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -133.75 -49.28 0.82 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.881 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 73.4 m 60.28 34.96 20.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.911 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -97.65 30.71 2.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.158 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -116.93 -179.78 17.67 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.503 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -132.84 127.5 4.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.53 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.0 t -89.03 141.19 28.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.814 0.34 . . . . 0.0 110.833 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.7 m -116.54 142.5 46.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.876 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.495 ' O ' HG13 ' A' ' 93' ' ' VAL . 11.1 p -62.27 118.65 4.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.092 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 166.19 80.34 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.535 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.421 ' CE3' ' HA ' ' A' ' 95' ' ' TRP . 0.1 OUTLIER -177.58 100.81 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.734 0.302 . . . . 0.0 110.843 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -143.71 44.32 1.49 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.977 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -173.89 136.88 0.67 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.981 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.13 167.62 25.61 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.458 2.105 . . . . 0.0 112.429 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.34 -16.71 31.14 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.624 2.216 . . . . 0.0 112.534 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.7 139.16 45.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.907 0.384 . . . . 0.0 111.257 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.71 134.35 21.31 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.83 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.32 151.92 27.64 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.405 2.07 . . . . 0.0 112.333 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.2 mm? 61.59 119.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.042 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -165.15 99.8 0.74 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.847 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.09 -52.38 4.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.916 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -101.5 146.33 32.03 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.958 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.53 138.77 30.22 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.506 2.137 . . . . 0.0 112.244 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 67.2 m -101.16 106.57 17.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.907 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 53.6 p -70.66 148.74 95.19 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.884 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.2 -170.21 0.47 Allowed 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.611 2.207 . . . . 0.0 112.303 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.407 ' N ' ' HD3' ' A' ' 112' ' ' PRO . . . -138.89 61.71 0.57 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.574 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.407 ' HD3' ' N ' ' A' ' 111' ' ' GLY . 36.5 Cg_exo -57.4 -177.34 0.08 OUTLIER 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.542 2.162 . . . . 0.0 112.242 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.69 84.91 0.2 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.022 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.65 158.4 55.89 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.58 2.187 . . . . 0.0 112.283 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 56.4 mtt-85 -74.29 108.22 6.95 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.92 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.8 p-10 -97.55 -32.13 11.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.872 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.652 HD12 ' HD3' ' A' ' 43' ' ' PRO . 0.3 OUTLIER -140.89 -69.69 0.38 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.812 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 39.9 m 61.04 -82.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.24 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.7 -169.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.063 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.649 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -131.73 -174.86 3.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.06 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.455 ' HD2' HG12 ' A' ' 155' ' ' VAL . 31.8 mttt -131.74 91.51 3.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.951 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -70.1 134.49 48.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.763 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.582 HG13 ' HB2' ' A' ' 148' ' ' ALA . 22.0 t -133.65 116.86 25.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.079 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.64 ' C ' HD22 ' A' ' 125' ' ' LEU . 5.1 m -62.46 164.5 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.984 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.777 HD23 ' HA ' ' A' ' 38' ' ' ALA . 4.4 mm? -124.48 33.55 5.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.911 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -145.33 35.93 1.09 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.891 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.5 tpt -178.67 -37.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.994 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.12 -169.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.306 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.537 ' HA ' HG21 ' A' ' 176' ' ' ILE . 0.4 OUTLIER -167.87 122.85 1.0 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.537 179.894 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.69 HG12 HD12 ' A' ' 176' ' ' ILE . 2.2 p -98.61 159.31 3.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.288 0.565 . . . . 0.0 111.525 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.473 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 12.5 m -162.94 157.7 21.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.743 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.412 ' HB3' ' NH1' ' A' ' 132' ' ' ARG . 12.7 ttp-105 -140.09 117.95 11.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.956 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -117.01 -175.1 2.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.831 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 26.0 p -111.5 -177.94 3.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.063 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 16.4 p -139.46 158.63 68.22 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.837 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -60.25 -17.03 44.12 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.765 2.31 . . . . 0.0 112.801 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.1 p -135.66 37.05 2.88 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.674 0.273 . . . . 0.0 111.112 -179.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.403 ' HA ' ' HD3' ' A' ' 139' ' ' PRO . 0.9 OUTLIER -77.55 111.14 15.42 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.934 179.931 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 138' ' ' ASP . 14.7 Cg_exo -68.85 -42.24 4.7 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.609 2.206 . . . . 0.0 111.971 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.5 ' CB ' ' HD3' ' A' ' 141' ' ' PRO . 1.6 mt-10 -164.25 -56.77 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.927 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.5 ' HD3' ' CB ' ' A' ' 140' ' ' GLU . 24.6 Cg_exo -62.85 106.27 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.376 2.051 . . . . 0.0 112.039 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.27 160.7 18.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.026 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -75.39 141.68 43.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.867 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.786 HD21 ' HB2' ' A' ' 169' ' ' ALA . 7.1 mt -120.39 126.51 50.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.793 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -134.53 132.16 38.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.885 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.547 HD13 HG21 ' A' ' 172' ' ' ILE . 18.5 mt -129.49 125.8 62.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.128 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 30.4 p -104.74 130.96 52.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.738 ' HB3' ' HB2' ' A' ' 153' ' ' ASP . . . -110.18 147.31 33.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.167 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -94.97 30.57 2.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.306 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -115.74 45.29 1.73 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.191 0.519 . . . . 0.0 110.139 179.433 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 118.68 22.16 3.73 Favored Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.191 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.41 ' NE2' ' HA ' ' A' ' 152' ' ' GLN . 4.0 mm-40 58.74 61.65 2.13 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 121.14 0.495 . . . . 0.0 110.826 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.738 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 4.6 m-20 -88.12 158.96 18.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.802 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -157.21 85.44 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.191 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.455 HG12 ' HD2' ' A' ' 121' ' ' LYS . 4.7 m -80.0 123.82 37.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.192 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -105.91 106.54 17.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.644 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.607 ' CB ' HD22 ' A' ' 12' ' ' LEU . 2.1 mt -119.85 160.85 21.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.151 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.423 ' HB2' ' CZ3' ' A' ' 27' ' ' TRP . 22.5 ttt180 -132.46 107.74 8.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.764 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.983 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -58.68 173.05 0.44 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.228 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.02 -29.4 14.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.888 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -123.66 143.99 49.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.906 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -45.96 82.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.962 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -66.71 -39.94 88.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.007 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 68.4 m -61.91 -48.92 78.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.686 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.983 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -59.52 -39.75 84.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.031 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 5.0 mtt85 -69.9 -46.71 64.82 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.41 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.5 t -64.51 -33.23 75.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.219 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.774 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 7.4 m95 -72.93 -51.25 19.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.845 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.786 ' HB2' HD21 ' A' ' 144' ' ' LEU . . . -55.72 -56.26 22.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.309 0.576 . . . . 0.0 110.516 179.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -57.41 -36.85 78.79 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.752 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -71.84 -39.86 69.46 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.157 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.547 HG21 HD13 ' A' ' 146' ' ' ILE . 7.4 mt -63.58 -22.2 30.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.606 -0.886 . . . . 0.0 108.606 177.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.577 ' N ' HG11 ' A' ' 130' ' ' VAL . 1.2 tp60 -77.76 -40.88 39.45 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.483 179.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . 0.816 ' HA ' HG22 ' A' ' 178' ' ' THR . . . -65.49 -33.05 75.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.766 179.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . 0.408 ' HB3' HD12 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -82.58 -29.39 30.29 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.09 179.268 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.69 HD12 HG12 ' A' ' 130' ' ' VAL . 17.2 mt -71.59 -27.75 29.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.691 179.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 115.56 39.22 0.93 Allowed Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.612 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . 0.816 HG22 ' HA ' ' A' ' 174' ' ' ALA . 1.6 t . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.182 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.898 0.38 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.08 -175.39 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.96 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 167.29 178.17 39.38 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.46 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 5.5 ttt85 -131.08 -47.07 1.01 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.789 0.328 . . . . 0.0 110.863 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.63 97.24 2.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.897 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -165.03 88.56 1.01 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.15 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -69.3 156.08 65.56 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 122.552 2.168 . . . . 0.0 112.356 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.491 ' HD2' HD23 ' A' ' 34' ' ' LEU . 4.3 ptp180 -112.93 135.69 53.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.868 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.4 p -124.61 168.44 13.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.966 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.55 126.71 1.25 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.47 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.502 HD22 ' HD3' ' A' ' 29' ' ' ARG . 10.5 mt -59.68 128.05 35.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.843 0.354 . . . . 0.0 110.932 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.853 HD21 HD12 ' A' ' 144' ' ' LEU . 0.2 OUTLIER -145.48 140.68 27.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.806 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.95 154.93 37.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.939 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 16.1 tp -134.73 130.96 37.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.452 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.506 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 2.6 ttp180 -69.38 166.98 17.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.801 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.4 t -124.91 -43.13 2.0 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.849 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 131.37 170.31 12.61 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.598 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.58 131.34 38.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.875 0.369 . . . . 0.0 111.085 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 128.53 52.16 0.12 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.524 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 p -145.26 -58.9 0.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.771 0.319 . . . . 0.0 110.933 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -145.32 -142.29 3.8 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.542 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -81.32 139.63 35.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.752 0.31 . . . . 0.0 111.175 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.93 -49.48 0.88 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.499 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 100.62 24.66 9.16 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.568 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -155.09 149.61 26.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.835 0.35 . . . . 0.0 110.799 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.525 HH21 HD23 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -131.47 49.17 2.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.825 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.506 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 43.0 m95 -48.13 160.13 0.16 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.02 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -153.17 158.08 41.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.095 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.502 ' HD3' HD22 ' A' ' 11' ' ' LEU . 1.5 ttm180 -82.34 123.56 29.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.946 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.682 HG12 ' HA ' ' A' ' 43' ' ' PRO . 20.5 m -143.31 123.22 9.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.209 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 11' ' ' LEU . 1.0 OUTLIER -69.85 134.85 48.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.613 179.762 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.84 121.85 41.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.979 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.2 t -100.37 86.0 3.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.694 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.501 HD12 ' CG ' ' A' ' 39' ' ' LEU . 1.7 tp -80.27 129.65 34.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.028 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.655 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -135.26 138.67 43.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.06 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.72 -23.69 44.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.037 0.446 . . . . 0.0 111.285 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -88.83 -30.15 19.16 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.929 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.655 ' O ' ' HB3' ' A' ' 35' ' ' ALA . . . -175.41 173.01 2.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.032 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.501 ' CG ' HD12 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -114.71 129.01 56.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.942 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.496 ' CG2' ' HB1' ' A' ' 120' ' ' ALA . 28.6 m -128.33 129.65 46.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.752 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.461 HG12 ' N ' ' A' ' 42' ' ' SER . 13.9 t -107.28 159.02 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.317 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.461 ' N ' HG12 ' A' ' 41' ' ' VAL . 11.3 t -159.59 149.0 14.46 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.451 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.682 ' HA ' HG12 ' A' ' 30' ' ' VAL . 66.7 Cg_endo -75.07 43.03 0.92 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.654 2.236 . . . . 0.0 113.23 -179.663 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 45.52 29.51 0.63 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.939 0.399 . . . . 0.0 111.846 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -111.56 -168.52 1.32 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.017 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -112.85 -158.44 13.47 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.484 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -144.73 92.98 5.77 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.651 0.262 . . . . 0.0 110.959 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -68.57 163.1 38.17 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.466 2.111 . . . . 0.0 112.284 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -108.21 -94.5 2.34 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.547 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.65 108.56 0.26 Allowed 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.554 2.169 . . . . 0.0 112.326 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -147.86 138.75 13.21 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.793 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.16 135.68 27.66 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.424 2.083 . . . . 0.0 112.299 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -73.49 116.04 47.43 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.788 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.32 63.79 1.54 Allowed 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.41 2.073 . . . . 0.0 112.287 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -152.67 155.3 37.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.097 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.24 93.52 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.888 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.8 mt -76.21 -54.7 6.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.923 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.3 t30 60.84 31.26 20.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.849 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.0 -158.89 22.28 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.549 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.58 105.16 3.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.863 0.363 . . . . 0.0 111.129 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -107.11 135.07 49.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.029 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -80.99 135.19 51.73 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.877 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.49 127.21 10.86 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.511 2.141 . . . . 0.0 112.325 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -109.77 147.53 17.15 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.514 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.14 -177.35 0.11 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.767 0.318 . . . . 0.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -130.26 99.31 19.61 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.066 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.86 157.43 61.83 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.43 2.087 . . . . 0.0 112.303 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.467 ' HB3' HD11 ' A' ' 74' ' ' LEU . 56.5 Cg_endo -70.79 136.16 29.63 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.617 2.211 . . . . 0.0 112.358 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -98.61 126.2 44.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.908 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.525 HD23 HH21 ' A' ' 26' ' ' ARG . 1.0 OUTLIER 60.05 108.61 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.841 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -57.59 -160.7 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.47 2.113 . . . . 0.0 112.21 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.549 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.8 mt-10 66.3 74.5 0.35 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.458 0.647 . . . . 0.0 110.211 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 72' ' ' GLU . . . 165.0 -28.67 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.795 -1.093 . . . . 0.0 110.327 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.467 HD11 ' HB3' ' A' ' 68' ' ' PRO . 7.6 mt -115.19 -18.66 11.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.193 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.767 HD22 ' O ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -99.43 -2.72 35.39 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.555 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.541 ' H ' HD23 ' A' ' 76' ' ' LEU . 2.6 pt? -57.43 -44.39 84.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.765 0.317 . . . . 0.0 111.489 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.48 ' N ' ' HG ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER 46.86 28.59 0.86 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.391 179.889 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -120.73 -36.18 3.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.186 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -98.99 31.63 2.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.903 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.4 t -143.76 -46.4 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.187 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 9.9 t 62.85 142.98 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.966 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.09 59.06 6.4 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.619 2.213 . . . . 0.0 112.424 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -170.29 74.04 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.894 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -155.99 153.48 29.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.946 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt -65.73 158.72 26.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.937 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -126.88 31.33 5.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.952 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.96 92.18 8.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.837 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -164.04 174.09 11.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.038 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 166.57 -148.92 14.12 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.56 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.481 ' O ' HG22 ' A' ' 91' ' ' THR . . . 126.12 58.6 0.15 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.501 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.481 HG22 ' O ' ' A' ' 90' ' ' GLY . 15.1 t 45.19 -167.22 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.812 0.339 . . . . 0.0 111.315 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 56.1 m -90.82 113.45 25.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.903 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.9 p -88.64 148.66 4.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.131 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 155.57 -61.31 0.36 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.488 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER 60.68 83.98 0.13 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.855 0.36 . . . . 0.0 110.914 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -176.68 67.53 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.854 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 66.7 m -115.6 84.84 12.88 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.063 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.448 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 55.8 Cg_exo -52.15 128.12 26.06 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.594 2.196 . . . . 0.0 112.172 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 98' ' ' PRO . 22.7 Cg_exo -64.29 -27.13 63.76 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.379 2.053 . . . . 0.0 112.09 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -132.76 127.7 35.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.021 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.3 p -117.48 86.22 22.22 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.917 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -69.01 147.07 66.9 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.599 2.2 . . . . 0.0 112.255 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.54 100.62 9.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -105.63 160.66 15.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.819 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.47 149.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.89 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.4 138.82 89.13 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.812 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.19 168.24 0.61 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.485 2.123 . . . . 0.0 112.294 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.9 t -91.34 166.22 13.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.878 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.429 ' CB ' ' CD ' ' A' ' 110' ' ' PRO . 0.4 OUTLIER 179.41 -60.89 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.068 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 109' ' ' SER . 62.8 Cg_endo -74.33 125.16 9.49 Favored 'Trans proline' 0 N--CA 1.466 -0.145 0 C-N-CA 122.855 2.37 . . . . 0.0 112.315 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 77.4 105.77 0.16 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.46 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -49.53 164.06 0.38 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.539 2.16 . . . . 0.0 112.367 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -75.23 147.5 82.98 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.08 162.13 42.66 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.557 2.172 . . . . 0.0 112.301 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.38 177.75 10.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.824 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -69.21 -45.57 69.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.783 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 19.6 tp -166.53 115.98 0.92 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.907 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 2.7 m -111.77 -33.52 6.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.987 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -111.63 -177.94 3.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.97 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.496 ' HB1' ' CG2' ' A' ' 40' ' ' THR . . . -86.67 154.36 21.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.187 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 94.11 6.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.803 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -86.33 104.54 15.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.996 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.2 t -108.19 139.89 28.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.039 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.9 152.21 19.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.961 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.423 HD13 ' HB2' ' A' ' 39' ' ' LEU . 4.8 tp -131.95 31.47 4.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.903 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.95 41.74 2.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.724 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 174.88 -32.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.914 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.32 -171.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.378 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -161.23 107.1 1.38 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.587 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.599 HG11 ' N ' ' A' ' 173' ' ' GLN . 1.6 p -80.23 158.64 4.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.233 0.539 . . . . 0.0 111.359 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.472 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.4 OUTLIER -160.48 150.04 17.53 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.646 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.5 ptt85 -124.0 111.48 16.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.086 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.49 177.74 4.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.816 179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 30.5 p -100.66 137.38 39.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.989 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.559 HG22 ' HD2' ' A' ' 136' ' ' PRO . 0.2 OUTLIER -101.07 140.7 21.51 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.744 179.938 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . 0.559 ' HD2' HG22 ' A' ' 135' ' ' THR . 72.6 Cg_endo -76.22 -15.59 18.05 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.593 2.195 . . . . 0.0 112.659 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 66.6 p -78.03 -45.31 24.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.917 0.389 . . . . 0.0 111.068 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -136.19 144.87 49.74 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.906 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -83.6 -44.84 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.753 2.302 . . . . 0.0 112.789 -179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.492 ' CB ' ' HD3' ' A' ' 141' ' ' PRO . 0.2 OUTLIER -64.87 -57.66 15.4 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.316 -179.514 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.492 ' HD3' ' CB ' ' A' ' 140' ' ' GLU . 46.1 Cg_exo -56.29 103.86 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.344 2.029 . . . . 0.0 112.221 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.58 116.98 20.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.737 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.44 ' HD2' HG23 ' A' ' 135' ' ' THR . 1.9 t80 -57.89 119.41 6.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.829 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.853 HD12 HD21 ' A' ' 12' ' ' LEU . 91.4 mt -96.2 139.88 31.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.918 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -148.1 130.02 15.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.729 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 14.8 mt -130.89 123.26 53.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.295 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 60.1 m -108.42 119.38 39.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.667 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -100.11 143.14 30.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.377 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -96.58 30.89 2.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.167 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -121.35 47.8 1.78 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.381 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 125.69 18.7 2.39 Favored Glycine 0 CA--C 1.519 0.292 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.524 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 58.95 60.93 2.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.973 0.416 . . . . 0.0 110.925 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -93.44 152.94 18.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.713 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -160.49 86.88 0.74 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.085 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 155' ' ' VAL . 35.5 m -84.12 124.83 40.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.111 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -109.47 102.47 11.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.904 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.0 mt -113.67 167.99 10.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.136 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.452 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 5.5 ttt-85 -144.4 97.6 3.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.702 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 1.049 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -55.69 171.28 0.22 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.423 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.42 -30.54 13.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.029 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -105.97 164.83 11.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.893 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -79.98 -65.31 1.02 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.958 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -60.04 -26.79 66.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.151 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 4.5 t -68.96 -43.49 74.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.908 0.385 . . . . 0.0 110.282 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 1.049 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -73.31 -28.23 61.97 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.544 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 11.1 ptt85 -79.28 -40.48 30.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.429 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 8.3 t -70.95 -31.76 68.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.108 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.487 ' O ' HD12 ' A' ' 172' ' ' ILE . 9.9 m95 -71.51 -47.4 55.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.854 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.424 ' HB2' ' CD2' ' A' ' 144' ' ' LEU . . . -58.17 -48.95 78.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.263 0.554 . . . . 0.0 110.465 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.45 -42.48 95.85 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.581 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -69.89 -40.76 75.47 Favored 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 120.854 -0.338 . . . . 0.0 110.746 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.56 ' C ' HG11 ' A' ' 130' ' ' VAL . 11.8 mt -61.11 -23.12 28.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.599 ' N ' HG11 ' A' ' 130' ' ' VAL . 1.2 tt0 -77.74 -42.1 35.41 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.618 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . 0.49 ' HA ' HG22 ' A' ' 178' ' ' THR . . . -64.82 -43.68 92.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.487 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 74.6 mm-40 -67.28 -37.23 83.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.074 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.404 HD13 HG22 ' A' ' 172' ' ' ILE . 0.1 OUTLIER -59.8 -33.27 51.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.694 179.494 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . 124.84 54.29 0.18 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.593 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . 0.49 HG22 ' HA ' ' A' ' 174' ' ' ALA . 4.7 t . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.072 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.823 0.344 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.6 p -99.1 114.32 26.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.852 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.93 82.41 1.68 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.499 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -163.49 96.25 0.85 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.783 0.325 . . . . 0.0 110.839 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.73 98.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.817 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.36 112.58 5.39 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.116 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -67.31 160.64 46.74 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.399 2.066 . . . . 0.0 112.309 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -110.61 144.85 38.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.739 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.667 HG22 ' HA ' ' A' ' 33' ' ' SER . 18.2 p -133.32 164.03 28.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -158.08 118.64 0.84 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.338 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.853 HD22 ' HD3' ' A' ' 29' ' ' ARG . 17.8 mt -59.44 93.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.843 0.354 . . . . 0.0 110.913 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.812 HD13 HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -96.32 170.04 9.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.787 -179.994 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -110.94 146.93 35.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.964 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 27' ' ' TRP . 14.6 tp -125.37 142.99 51.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.738 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.478 ' HB2' ' CZ2' ' A' ' 27' ' ' TRP . 0.6 OUTLIER -69.44 170.58 10.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.697 -179.837 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -170.26 34.75 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.897 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -111.03 166.81 12.33 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.501 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.514 ' HB3' HD21 ' A' ' 70' ' ' LEU . . . -134.68 39.07 3.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.807 0.337 . . . . 0.0 111.098 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.04 174.77 29.4 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.482 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.4 m -127.45 132.4 50.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.841 0.353 . . . . 0.0 110.871 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.15 23.71 5.99 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.589 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 56.2 -168.67 0.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.84 0.353 . . . . 0.0 111.183 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 136.15 -53.49 0.76 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.462 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -174.73 53.41 0.13 Allowed Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.492 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -59.79 150.38 28.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.869 0.366 . . . . 0.0 110.917 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -109.12 46.63 0.97 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.952 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.478 ' CZ2' ' HB2' ' A' ' 15' ' ' ARG . 12.1 m95 -54.26 91.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.904 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -65.95 178.97 0.97 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.136 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.853 ' HD3' HD22 ' A' ' 11' ' ' LEU . 3.8 tmm_? -117.92 110.82 18.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.824 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.839 HG12 ' HA ' ' A' ' 43' ' ' PRO . 29.0 m -113.96 138.44 43.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.157 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.0 tp -83.69 127.42 33.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.561 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.828 HD12 HG13 ' A' ' 41' ' ' VAL . 2.6 mp -98.16 101.28 12.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.119 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.667 ' HA ' HG22 ' A' ' 9' ' ' THR . 0.7 OUTLIER -86.45 94.03 9.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.648 179.735 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.523 HD12 HD11 ' A' ' 39' ' ' LEU . 2.1 tp -87.69 129.81 35.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.992 -179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 38' ' ' ALA . . . -135.72 140.07 44.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.972 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.7 -23.09 49.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.072 0.463 . . . . 0.0 111.251 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -86.47 -30.85 21.71 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.93 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.546 ' HA ' HD22 ' A' ' 125' ' ' LEU . . . -178.16 -178.66 0.67 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.99 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.523 HD11 HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -113.37 157.6 21.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.922 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.667 HG23 ' CD2' ' A' ' 122' ' ' HIS . 24.7 m -158.24 128.02 5.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.626 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.828 HG13 HD12 ' A' ' 32' ' ' LEU . 10.7 t -119.78 157.97 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.012 0.434 . . . . 0.0 111.348 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.452 ' N ' HG12 ' A' ' 41' ' ' VAL . 12.5 t -160.1 157.57 25.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.406 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.839 ' HA ' HG12 ' A' ' 30' ' ' VAL . 7.0 Cg_exo -73.85 39.56 0.52 Allowed 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.732 2.288 . . . . 0.0 112.973 -179.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 44.98 29.56 0.48 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.018 0.437 . . . . 0.0 111.404 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -115.64 172.63 7.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.884 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -91.44 81.16 1.26 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.468 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -61.81 154.12 68.7 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.807 0.337 . . . . 0.0 110.908 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.67 165.34 27.89 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.513 2.142 . . . . 0.0 112.314 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -117.38 -147.8 8.61 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.485 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -68.9 -27.8 30.32 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.648 2.232 . . . . 0.0 112.264 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -145.89 91.36 5.62 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.964 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.01 -167.66 0.17 Allowed 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 122.546 2.164 . . . . 0.0 112.338 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -138.26 107.8 8.01 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.884 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -50.83 141.06 36.85 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.487 2.125 . . . . 0.0 112.387 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -99.92 -177.76 3.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.197 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.6 110.48 20.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.849 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 5.6 mt -74.48 -50.57 17.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 68.86 -67.51 0.21 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.999 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -170.57 -132.22 1.44 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.474 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . 59.93 168.83 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.827 0.346 . . . . 0.0 111.124 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.88 -175.56 0.31 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.081 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -144.53 142.08 18.79 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.915 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -73.78 164.74 33.95 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.535 2.157 . . . . 0.0 112.335 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 172.56 62.17 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.531 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.89 145.59 55.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 0.0 111.064 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.495 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -91.92 148.72 37.56 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.095 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.487 ' N ' ' CD ' ' A' ' 68' ' ' PRO . 31.7 Cg_exo -56.99 -46.23 30.53 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.46 2.107 . . . . 0.0 112.802 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.495 ' HD2' ' HB1' ' A' ' 66' ' ' ALA . 94.3 Cg_endo -82.35 -169.66 0.79 Allowed 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.891 2.394 . . . . 0.0 112.371 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 61.66 152.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.9 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.782 HD13 ' HD2' ' A' ' 71' ' ' PRO . 0.2 OUTLIER -100.61 121.88 51.4 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.733 179.984 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.782 ' HD2' HD13 ' A' ' 70' ' ' LEU . 31.8 Cg_exo -58.31 -156.42 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.447 2.098 . . . . 0.0 112.262 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 65.38 72.1 0.43 Allowed 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.516 0.674 . . . . 0.0 110.543 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -177.96 -43.08 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.813 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.41 ' N ' HD12 ' A' ' 74' ' ' LEU . 5.8 mp -100.4 6.49 44.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.28 178.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.856 HD22 ' O ' ' A' ' 75' ' ' LEU . 0.2 OUTLIER -113.44 -37.41 4.66 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.535 -179.654 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.825 HD13 ' N ' ' A' ' 77' ' ' GLN . 0.1 OUTLIER -87.23 -51.0 6.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.652 179.999 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.825 ' N ' HD13 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -67.1 127.02 31.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 179.977 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.77 -60.76 0.33 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.851 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -97.38 36.75 1.43 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.937 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.3 t -112.5 -50.86 5.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.116 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.6 t -89.39 142.9 30.05 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.947 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.07 59.03 6.38 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.579 2.186 . . . . 0.0 112.426 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -176.29 38.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.859 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -147.42 97.4 2.85 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.87 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -132.2 126.09 32.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.921 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -141.35 114.83 8.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.904 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 63.58 125.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.896 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 60.93 165.36 0.08 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.102 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 102.42 -53.1 0.79 Allowed Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.51 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -158.49 70.74 0.25 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.547 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 70.0 p -95.56 154.66 17.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 110.902 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.63 21.72 1.65 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.111 0.482 . . . . 0.0 111.081 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.467 HG22 ' N ' ' A' ' 94' ' ' GLY . 11.2 p -78.19 157.05 5.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.044 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.467 ' N ' HG22 ' A' ' 93' ' ' VAL . . . -176.14 -38.3 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.528 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 -119.82 72.51 0.93 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.944 0.402 . . . . 0.0 110.898 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.64 45.05 1.61 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.943 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.8 m -130.52 142.99 47.47 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.938 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.481 ' HA ' ' HD3' ' A' ' 99' ' ' PRO . 51.4 Cg_exo -54.4 130.07 38.0 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.434 2.089 . . . . 0.0 112.208 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 98' ' ' PRO . 16.1 Cg_exo -67.85 -27.25 37.51 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.444 2.096 . . . . 0.0 111.899 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -144.31 146.17 32.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.041 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -176.72 86.05 0.26 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.842 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.54 61.96 3.6 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.574 2.182 . . . . 0.0 112.239 179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 103' ' ' LEU . 4.4 mm? -115.49 124.68 51.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.891 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -88.7 -38.75 14.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.91 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -70.89 178.66 3.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.812 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.18 146.65 34.33 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.854 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.26 173.19 13.43 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.483 2.122 . . . . 0.0 112.328 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.58 111.25 13.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.836 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.9 m -137.84 89.1 15.36 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.917 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.22 146.82 64.79 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.555 2.17 . . . . 0.0 112.313 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -79.06 152.6 36.73 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.483 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.69 148.85 26.65 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.621 2.214 . . . . 0.0 112.268 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -128.24 139.21 34.81 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.909 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.28 90.69 1.17 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.575 2.183 . . . . 0.0 112.339 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.3 mtp180 -94.64 164.94 12.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.916 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -139.55 -48.78 0.48 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.929 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.514 HD12 ' O ' ' A' ' 117' ' ' LEU . 4.2 pp -135.17 136.47 41.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.888 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.5 -32.61 12.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.008 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -87.69 121.14 29.75 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.878 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.694 ' HB1' ' O ' ' A' ' 41' ' ' VAL . . . -71.09 -177.71 1.76 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.071 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.572 ' HD2' HG11 ' A' ' 155' ' ' VAL . 18.1 mttm -121.07 108.86 14.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.897 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.667 ' CD2' HG23 ' A' ' 40' ' ' THR . 14.1 m80 -109.92 144.63 38.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.949 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.643 HG13 ' HB2' ' A' ' 148' ' ' ALA . 4.0 t -123.39 127.32 74.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.869 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 56.4 p -58.27 -30.19 66.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.231 -179.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.546 HD22 ' HA ' ' A' ' 38' ' ' ALA . 2.1 mp 65.05 31.01 11.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.928 0.394 . . . . 0.0 110.832 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.18 36.12 3.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.716 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.588 ' HB3' ' HB3' ' A' ' 149' ' ' ALA . 1.5 mtp 170.01 -28.85 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.896 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -51.32 -177.86 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.976 0.417 . . . . 0.0 111.574 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -165.08 115.97 1.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.514 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.574 HG11 ' N ' ' A' ' 173' ' ' GLN . 2.1 p -89.66 158.61 2.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.287 0.565 . . . . 0.0 111.487 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 130' ' ' VAL . 0.3 OUTLIER -167.92 128.08 1.34 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.707 -179.947 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.27 112.21 24.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.083 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -90.77 174.25 7.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.762 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' CYS . . . . . . . . . . . . . 1.2 m -105.64 163.47 12.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.015 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.703 HG23 ' CE2' ' A' ' 143' ' ' TYR . 1.7 m -127.41 116.68 21.41 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.815 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -54.18 -39.29 86.82 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.48 2.12 . . . . 0.0 112.35 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.92 -32.79 34.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.096 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.408 ' HB3' ' CG ' ' A' ' 141' ' ' PRO . 2.5 m-20 -127.03 75.34 76.62 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.838 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -59.67 -23.73 72.7 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.673 2.248 . . . . 0.0 112.572 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.453 ' CB ' ' CD ' ' A' ' 141' ' ' PRO . 0.8 OUTLIER -67.41 -64.49 2.03 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.2 -179.701 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.453 ' CD ' ' CB ' ' A' ' 140' ' ' GLU . 66.8 Cg_endo -73.7 130.15 14.37 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.4 2.066 . . . . 0.0 112.442 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.05 121.83 38.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.762 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.703 ' CE2' HG23 ' A' ' 135' ' ' THR . 4.9 m-85 -57.33 112.93 1.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.989 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.567 HD21 ' N ' ' A' ' 169' ' ' ALA . 1.1 mt -83.32 88.93 6.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.878 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -96.51 137.81 35.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.965 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.793 HD13 HG21 ' A' ' 172' ' ' ILE . 25.2 mt -141.46 126.76 18.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.035 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 63.8 m -114.22 130.6 56.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.049 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.643 ' HB2' HG13 ' A' ' 123' ' ' VAL . . . -112.15 152.03 28.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.103 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.588 ' HB3' ' HB3' ' A' ' 127' ' ' MET . . . -95.87 30.96 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.356 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -111.03 42.41 1.64 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.336 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 121.22 26.79 1.96 Allowed Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.354 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 57.59 59.24 3.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.106 0.479 . . . . 0.0 111.006 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . 0.443 ' HB2' ' HB3' ' A' ' 148' ' ' ALA . 0.7 OUTLIER -90.13 152.3 21.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.774 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -163.13 94.23 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.056 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.572 HG11 ' HD2' ' A' ' 121' ' ' LYS . 10.8 m -95.76 132.98 38.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.169 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.449 ' CD1' ' N ' ' A' ' 156' ' ' PHE . 0.7 OUTLIER -119.06 98.77 6.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.897 179.918 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.58 HD13 HD21 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -106.02 167.92 9.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.937 -179.922 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' ARG . . . . . 0.446 ' HB2' ' CH2' ' A' ' 27' ' ' TRP . 0.9 OUTLIER -129.46 107.34 9.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.776 179.976 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.789 ' HB3' ' HB2' ' A' ' 165' ' ' ALA . . . -59.39 173.45 0.51 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.15 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.23 -30.14 16.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.039 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -122.53 157.78 31.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.929 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.09 -42.62 69.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.062 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.7 76.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.98 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 60.4 p -63.9 -44.26 93.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.653 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.789 ' HB2' ' HB3' ' A' ' 159' ' ' ALA . . . -62.84 -43.86 97.68 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.923 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.67 -42.4 77.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.484 179.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 91.1 p -66.57 -34.67 78.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.2 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' TRP . . . . . 0.491 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 12.1 m95 -73.0 -50.13 24.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.785 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . 0.567 ' N ' HD21 ' A' ' 144' ' ' LEU . . . -56.31 -51.13 69.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.271 0.557 . . . . 0.0 110.592 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . -58.73 -41.31 95.79 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.71 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.41 -41.33 80.6 Favored 'General case' 0 CA--C 1.511 -0.544 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.141 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.873 HG22 HD12 ' A' ' 176' ' ' ILE . 7.0 mt -62.41 -23.38 32.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.574 ' N ' HG11 ' A' ' 130' ' ' VAL . 0.4 OUTLIER -79.97 -30.73 39.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.353 179.286 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -66.36 -47.03 74.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.423 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -71.05 -37.02 72.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.234 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 176' ' ' ILE . . . . . 0.873 HD12 HG22 ' A' ' 172' ' ' ILE . 70.3 mt -83.33 -5.95 9.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.373 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -88.12 27.42 6.81 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.321 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.911 -179.939 . . . . . . . . 0 0 . 1 stop_ save_